N-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide

C19H28N2O2 — CID 95322825

IUPACN-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide
SMILESCCN(Cc1ccccc1)C(=O)C[C@@H](C)NC(=O)C1CCCC1
InChIInChI=1S/C19H28N2O2/c1-3-21(14-16-9-5-4-6-10-16)18(22)13-15(2)20-19(23)17-11-7-8-12-17/h4-6,9-10,15,17H,3,7-8,11-14H2,1-2H3,(H,20,23)/t15-/m1/s1
InChIKeyWFJDCIFJCAEHHV-OAHLLOKOSA-N
MW316.44 g/mol
LogP3.12
Rot. Bonds7

About N-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide

N-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide (PubChem CID 95322825) has the molecular formula C19H28N2O2 and a molecular weight of 316.44 g/mol. Its IUPAC name is N-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide
PubChem CID95322825
Molecular FormulaC19H28N2O2
Molecular Weight316.44 g/mol
Exact Mass316.22
IUPAC NameN-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide
SMILESCCN(Cc1ccccc1)C(=O)C[C@@H](C)NC(=O)C1CCCC1
InChIInChI=1S/C19H28N2O2/c1-3-21(14-16-9-5-4-6-10-16)18(22)13-15(2)20-19(23)17-11-7-8-12-17/h4-6,9-10,15,17H,3,7-8,11-14H2,1-2H3,(H,20,23)/t15-/m1/s1
InChIKeyWFJDCIFJCAEHHV-OAHLLOKOSA-N
XLogP3.12
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.44
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide 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'-benzyl-N'-ethyl-N-propan-2-ylpropanediamide
CID 108940808
N-benzyl-N-ethylcyclobutanecarboxamide
CID 110755489
N-benzyl-2-[cyclopentyl(propan-2-yl)amino]-N-ethylacetamide
CID 56570177
N,N'-dibenzyl-N,N'-diethylpropanediamide
CID 2392254
N-[4-[(2-hydroxy-3-phenylpropyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide
CID 111102571
3-amino-N-[2-[benzyl(ethyl)amino]-2-oxoethyl]cyclohexane-1-carboxamide;hydrochloride
CID 119750884
N-[2-[benzyl(ethyl)amino]-2-oxoethyl]piperidine-3-carboxamide;hydrochloride
CID 119304521
(3R)-1-[2-[benzyl(ethyl)amino]-2-oxoethyl]piperidine-3-carboxylic acid
CID 39432909
(3R)-3-(cyclohexanecarbonylamino)butanoic acid
CID 51885508
N-[(2S)-4-phenylbutan-2-yl]cyclopropanecarboxamide
CID 844321
(2R)-2-[3-(cyclopentanecarbonylamino)butanoylamino]-2-phenylacetic acid
CID 119367850
(1R)-N-[2-[benzyl(ethyl)amino]-2-oxoethyl]cyclohex-3-ene-1-carboxamide
CID 94671381

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide?
The IUPAC name of N-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide (CID 95322825) is N-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide.
What is the SMILES notation for N-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide?
The canonical SMILES for N-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide is CCN(Cc1ccccc1)C(=O)C[C@@H](C)NC(=O)C1CCCC1.
What is the InChIKey of N-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide?
The InChIKey is WFJDCIFJCAEHHV-OAHLLOKOSA-N. The full InChI is InChI=1S/C19H28N2O2/c1-3-21(14-16-9-5-4-6-10-16)18(22)13-15(2)20-19(23)17-11-7-8-12-17/h4-6,9-10,15,17H,3,7-8,11-14H2,1-2H3,(H,20,23)/t15-/m1/s1.
What are the key properties of N-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide?
N-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide has a molecular weight of 316.44 g/mol, XLogP of 3.12, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-4-[benzyl(ethyl)amino]-4-oxobutan-2-yl]cyclopentanecarboxamide is sourced from PubChem (CID 95322825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).