Cas no 10264-05-8 (N-benzylpentanamide)
N-benzylpentanamide structure
Product Name:N-benzylpentanamide
CAS No:10264-05-8
MF:C12H17NO
MW:191.269483327866
CID:1133650
PubChem ID:3789502
Update Time:2025-04-20
N-benzylpentanamide Chemical and Physical Properties
Names and Identifiers
-
- N-benzylpentanamide
- AKOS003855833
- N-Benzyl-valeramid
- N-(phenylmethyl)-pentanamide
- N-benzyl-valeramide
- CTK0D8955
- AC1MXFB8
- pentanoic acid benzylamide
- Pentanamide, N-(phenylmethyl)-
- N-benzylvaleramide
- SureCN4401015
- ZINC05308230
- N-benzyl pentanamide
- AKOS003855833; N-Benzyl-valeramid; N-(phenylmethyl)-pentanamide; N-benzyl-valeramide; CTK0D8955; AC1MXFB8; pentanoic acid benzylamide; Pentanamide, N-(phenylmethyl)-; N-benzylvaleramide; SureCN4401015; ZINC05308230; N-benzyl pentanamide;
- SCHEMBL4401015
- 10264-05-8
- DTXSID60396436
-
- Inchi： 1S/C12H17NO/c1-2-3-9-12(14)13-10-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3,(H,13,14)
- InChI Key： PEFMXZJRCDFXFU-UHFFFAOYSA-N
- SMILES： O=C(CCCC)NCC1C=CC=CC=1
Computed Properties
- Exact Mass: 191.13111
- Monoisotopic Mass: 191.131014166g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 14
- Rotatable Bond Count: 5
- Complexity: 162
- 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: 2.6
- Topological Polar Surface Area: 29.1?2
Experimental Properties
- PSA: 29.1
N-benzylpentanamide Related Literature
-
Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
-
Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
-
Xiaotong Feng,Lei Bian,Jie Ma,Lei Zhou,Xiayan Wang,Guangsheng Guo,Qiaosheng Pu Chem. Commun., 2019,55, 3963-3966
-
Partha Laskar,Christine Dufès Nanoscale Adv., 2021,3, 6007-6026
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