Cas no 101035-79-4 (Benzamide,4-amino-N-[3-(diethylamino)propyl]-N-(phenylmethyl)-, hydrochloride (1:?))
101035-79-4 structure
Product Name:Benzamide,4-amino-N-[3-(diethylamino)propyl]-N-(phenylmethyl)-, hydrochloride (1:?)
CAS No:101035-79-4
MF:C21H30ClN3O
MW:375.93540430069
CID:161119
PubChem ID:58164
Update Time:2025-04-19
Benzamide,4-amino-N-[3-(diethylamino)propyl]-N-(phenylmethyl)-, hydrochloride (1:?) Chemical and Physical Properties
Names and Identifiers
-
- Benzamide,4-amino-N-[3-(diethylamino)propyl]-N-(phenylmethyl)-, hydrochloride (1:?)
- Benzamide,p-amino-N-benzyl-N-[3-(diethylamino)propyl]-, hydrochloride (7CI)
- 3-[(4-aminobenzoyl)-benzylamino]propyl-diethylazanium,chloride
- BENZAMIDE, p-AMINO-N-BENZYL-N-(3-(DIETHYLAMINO)PROPYL)-, HYDROCHLORIDE
- p-Amino-N-benzyl-N-(3-(diethylamino)propyl)benzamide hydrochloride
- 101035-79-4
-
- Inchi: 1S/C21H29N3O.ClH/c1-3-23(4-2)15-8-16-24(17-18-9-6-5-7-10-18)21(25)19-11-13-20(22)14-12-19;/h5-7,9-14H,3-4,8,15-17,22H2,1-2H3;1H
- InChI Key: ITAQCBPNCDGQSH-UHFFFAOYSA-N
- SMILES: [Cl-].O=C(C1C=CC(=CC=1)N)N(CC1C=CC=CC=1)CCC[NH+](CC)CC
Computed Properties
- Exact Mass: 344.9731
- Monoisotopic Mass: 375.20774
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 26
- Rotatable Bond Count: 9
- Complexity: 369
- Covalently-Bonded Unit Count: 2
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 50.8
Experimental Properties
- Boiling Point: 530.9°Cat760mmHg
- Flash Point: 274.8°C
- PSA: 48.51
- LogP: 5.02630
Benzamide,4-amino-N-[3-(diethylamino)propyl]-N-(phenylmethyl)-, hydrochloride (1:?) Related Literature
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Xixi Li,Nanwei Zhu,Ruohan Li,Qinpu Zhang Anal. Methods, 2020,12, 3376-3381
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Huabin Zhang,Shaowu Du CrystEngComm, 2014,16, 4059-4068
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José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
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Bo Cao,Yin Wei Chem. Commun., 2018,54, 2870-2873
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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