Cas no 89009-74-5 (1H-1,4-Diazepine-1-propanamide, hexahydro-N-propyl-)
89009-74-5 structure
Product Name:1H-1,4-Diazepine-1-propanamide, hexahydro-N-propyl-
CAS No:89009-74-5
MF:C11H23N3O
MW:213.31982254982
CID:616138
PubChem ID:54773684
Update Time:2025-04-19
1H-1,4-Diazepine-1-propanamide, hexahydro-N-propyl- Chemical and Physical Properties
Names and Identifiers
-
- 1H-1,4-Diazepine-1-propanamide, hexahydro-N-propyl-
- 3-(1,4-diazepan-1-yl)-N-propylpropanamide
- 89009-74-5
- DTXSID20716757
-
- Inchi: 1S/C11H23N3O/c1-2-5-13-11(15)4-9-14-8-3-6-12-7-10-14/h12H,2-10H2,1H3,(H,13,15)
- InChI Key: ZVYWJRFUEZWXTD-UHFFFAOYSA-N
- SMILES: O=C(CCN1CCNCCC1)NCCC
Computed Properties
- Exact Mass: 213.184112366g/mol
- Monoisotopic Mass: 213.184112366g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 15
- Rotatable Bond Count: 5
- Complexity: 185
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.1
- Topological Polar Surface Area: 44.4?2
1H-1,4-Diazepine-1-propanamide, hexahydro-N-propyl- Related Literature
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
-
Bidou Wang,Xifeng Chen Analyst, 2014,139, 5695-5699
-
José M. Rivera,Mariana Martín-Hidalgo,Jean C. Rivera-Ríos Org. Biomol. Chem., 2012,10, 7562-7565
-
Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
-
Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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