N-[3-[(1R)-1-[cyclopentylmethylcarbamoyl(methyl)amino]ethyl]phenyl]benzamide

C23H29N3O2 — CID 94122244

IUPACN-[3-[(1R)-1-[cyclopentylmethylcarbamoyl(methyl)amino]ethyl]phenyl]benzamide
SMILESC[C@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)NCC1CCCC1
InChIInChI=1S/C23H29N3O2/c1-17(26(2)23(28)24-16-18-9-6-7-10-18)20-13-8-14-21(15-20)25-22(27)19-11-4-3-5-12-19/h3-5,8,11-15,17-18H,6-7,9-10,16H2,1-2H3,(H,24,28)(H,25,27)/t17-/m1/s1
InChIKeyLUOFDEIPLZSMSQ-QGZVFWFLSA-N
MW379.50 g/mol
LogP4.83
Rot. Bonds6

About N-[3-[(1R)-1-[cyclopentylmethylcarbamoyl(methyl)amino]ethyl]phenyl]benzamide

N-[3-[(1R)-1-[cyclopentylmethylcarbamoyl(methyl)amino]ethyl]phenyl]benzamide (PubChem CID 94122244) has the molecular formula C23H29N3O2 and a molecular weight of 379.50 g/mol. Its IUPAC name is N-[3-[(1R)-1-[cyclopentylmethylcarbamoyl(methyl)amino]ethyl]phenyl]benzamide.

Molecular Properties

Compound NameN-[3-[(1R)-1-[cyclopentylmethylcarbamoyl(methyl)amino]ethyl]phenyl]benzamide
PubChem CID94122244
Molecular FormulaC23H29N3O2
Molecular Weight379.50 g/mol
Exact Mass379.23
IUPAC NameN-[3-[(1R)-1-[cyclopentylmethylcarbamoyl(methyl)amino]ethyl]phenyl]benzamide
SMILESC[C@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)NCC1CCCC1
InChIInChI=1S/C23H29N3O2/c1-17(26(2)23(28)24-16-18-9-6-7-10-18)20-13-8-14-21(15-20)25-22(27)19-11-4-3-5-12-19/h3-5,8,11-15,17-18H,6-7,9-10,16H2,1-2H3,(H,24,28)(H,25,27)/t17-/m1/s1
InChIKeyLUOFDEIPLZSMSQ-QGZVFWFLSA-N
XLogP4.83
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.50
LogP ≤ 54.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[3-[(1R)-1-[cyclopentylmethylcarbamoyl(methyl)amino]ethyl]phenyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-[(1S)-1-[cyclopentanecarbonyl(methyl)amino]ethyl]phenyl]benzamide
CID 51930710
4-benzamido-N-[1-(3-benzamidophenyl)ethyl]-N-methylbenzamide
CID 46537045
N-[3-[(1R)-1-[[2-[(3aS,7aR)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]acetyl]-methylamino]ethyl]phenyl]benzamide
CID 51728404
N-[(1R)-1-(3-benzamidophenyl)ethyl]-3-methoxy-N,4-dimethylbenzamide
CID 31870263
N-[3-[1-[(2-cyclohexylacetyl)amino]ethyl]phenyl]benzamide
CID 46456437
tert-butyl N-[3-[1-(3-benzamidophenyl)ethyl-methylcarbamoyl]phenyl]carbamate
CID 46533494
N-[1-(3-benzamidophenyl)ethyl]-N-methylpyridine-3-carboxamide
CID 46514714
N-[3-[1-[[2-(1-cyclopropylethylamino)-2-oxoethyl]-methylamino]ethyl]phenyl]benzamide
CID 43065532
N-[3-[1-[[2-(3-fluorophenyl)acetyl]-methylamino]ethyl]phenyl]benzamide
CID 46537955
N-[(1R)-1-(3-benzamidophenyl)ethyl]-N,3-dimethyl-1,2-oxazole-5-carboxamide
CID 31870185
N-[1-(3-benzamidophenyl)ethyl]-N-methyl-3-nitrobenzamide
CID 46533511
N-[3-[1-[4-(4-methoxyphenoxy)butanoyl-methylamino]ethyl]phenyl]benzamide
CID 46533483

Frequently Asked Questions

What is the IUPAC name of N-[3-[(1R)-1-[cyclopentylmethylcarbamoyl(methyl)amino]ethyl]phenyl]benzamide?
The IUPAC name of N-[3-[(1R)-1-[cyclopentylmethylcarbamoyl(methyl)amino]ethyl]phenyl]benzamide (CID 94122244) is N-[3-[(1R)-1-[cyclopentylmethylcarbamoyl(methyl)amino]ethyl]phenyl]benzamide.
What is the SMILES notation for N-[3-[(1R)-1-[cyclopentylmethylcarbamoyl(methyl)amino]ethyl]phenyl]benzamide?
The canonical SMILES for N-[3-[(1R)-1-[cyclopentylmethylcarbamoyl(methyl)amino]ethyl]phenyl]benzamide is C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)NCC1CCCC1.
What is the InChIKey of N-[3-[(1R)-1-[cyclopentylmethylcarbamoyl(methyl)amino]ethyl]phenyl]benzamide?
The InChIKey is LUOFDEIPLZSMSQ-QGZVFWFLSA-N. The full InChI is InChI=1S/C23H29N3O2/c1-17(26(2)23(28)24-16-18-9-6-7-10-18)20-13-8-14-21(15-20)25-22(27)19-11-4-3-5-12-19/h3-5,8,11-15,17-18H,6-7,9-10,16H2,1-2H3,(H,24,28)(H,25,27)/t17-/m1/s1.
What are the key properties of N-[3-[(1R)-1-[cyclopentylmethylcarbamoyl(methyl)amino]ethyl]phenyl]benzamide?
N-[3-[(1R)-1-[cyclopentylmethylcarbamoyl(methyl)amino]ethyl]phenyl]benzamide has a molecular weight of 379.50 g/mol, XLogP of 4.83, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(1R)-1-[cyclopentylmethylcarbamoyl(methyl)amino]ethyl]phenyl]benzamide is sourced from PubChem (CID 94122244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).