Cas no 5363-32-6 (2-(propan-2-ylamino)benzamide)
2-(propan-2-ylamino)benzamide structure
Product Name:2-(propan-2-ylamino)benzamide
CAS No:5363-32-6
MF:C10H14N2O
MW:178.230962276459
CID:1583461
PubChem ID:79323
Update Time:2025-04-21
2-(propan-2-ylamino)benzamide Chemical and Physical Properties
Names and Identifiers
-
- 2-(propan-2-ylamino)benzamide
- 2-(Isopropylamino)benzamide
- benzamide, 2-[(1-methylethyl)amino]-
- N-Isopropylanthranilamide
- 2-((1-methylethyl)amino)-Benzamide
- DTXSID80876063
- o-(Isopropylamino)benzamide
- Benzamide, o-(isopropylamino)-
- BENZAMIDE, O-ISOPROPYLAMINO-
- AKOS012408370
- BRN 0778972
- Benzamide, 2-((1-methylethyl)amino)-
- SCHEMBL2104582
- 5363-32-6
-
- Inchi： 1S/C10H14N2O/c1-7(2)12-9-6-4-3-5-8(9)10(11)13/h3-7,12H,1-2H3,(H2,11,13)
- InChI Key： HFZWIOMMCVHMSX-UHFFFAOYSA-N
- SMILES： O=C(C1C=CC=CC=1NC(C)C)N
Computed Properties
- Exact Mass: 178.11072
- Monoisotopic Mass: 178.110613074g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 13
- Rotatable Bond Count: 3
- Complexity: 180
- 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: 2.1
- Topological Polar Surface Area: 55.1?2
Experimental Properties
- PSA: 55.12
2-(propan-2-ylamino)benzamide Related Literature
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Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
-
Weili Dai,Guangjun Wu,Michael Hunger Chem. Commun., 2015,51, 13779-13782
-
Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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Craig A. Kelly,David R. Rosseinsky Phys. Chem. Chem. Phys., 2001,3, 2086-2090
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