4-[[(2R)-2-cyclopentylsulfanylpropanoyl]amino]benzamide

C15H20N2O2S — CID 7825696

IUPAC4-[[(2R)-2-cyclopentylsulfanylpropanoyl]amino]benzamide
SMILESC[C@@H](SC1CCCC1)C(=O)Nc1ccc(C(N)=O)cc1
InChIInChI=1S/C15H20N2O2S/c1-10(20-13-4-2-3-5-13)15(19)17-12-8-6-11(7-9-12)14(16)18/h6-10,13H,2-5H2,1H3,(H2,16,18)(H,17,19)/t10-/m1/s1
InChIKeyCJXNRRLVXKYEKY-SNVBAGLBSA-N
MW292.40 g/mol
LogP2.79
Rot. Bonds5

About 4-[[(2R)-2-cyclopentylsulfanylpropanoyl]amino]benzamide

4-[[(2R)-2-cyclopentylsulfanylpropanoyl]amino]benzamide (PubChem CID 7825696) has the molecular formula C15H20N2O2S and a molecular weight of 292.40 g/mol. Its IUPAC name is 4-[[(2R)-2-cyclopentylsulfanylpropanoyl]amino]benzamide.

Molecular Properties

Compound Name4-[[(2R)-2-cyclopentylsulfanylpropanoyl]amino]benzamide
PubChem CID7825696
Molecular FormulaC15H20N2O2S
Molecular Weight292.40 g/mol
Exact Mass292.12
IUPAC Name4-[[(2R)-2-cyclopentylsulfanylpropanoyl]amino]benzamide
SMILESC[C@@H](SC1CCCC1)C(=O)Nc1ccc(C(N)=O)cc1
InChIInChI=1S/C15H20N2O2S/c1-10(20-13-4-2-3-5-13)15(19)17-12-8-6-11(7-9-12)14(16)18/h6-10,13H,2-5H2,1H3,(H2,16,18)(H,17,19)/t10-/m1/s1
InChIKeyCJXNRRLVXKYEKY-SNVBAGLBSA-N
XLogP2.79
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-[[(2R)-2-cyclopentylsulfanylpropanoyl]amino]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

4-[[(2S)-2-cyclopentylsulfanylpropanoyl]amino]benzamide
CID 7825695
(2S)-N-(4-acetylphenyl)-2-cyclopentylsulfanylpropanamide
CID 7825638
(2S)-N-(4-acetamidophenyl)-2-cyclopentylsulfanylpropanamide
CID 7395629
(2S)-N-(4-chlorophenyl)-2-cyclopentylsulfanylpropanamide
CID 7398220
N-[4-[(2S)-2-cyclohexylsulfanylpropanoyl]phenyl]acetamide
CID 25498898
(2S)-2-cyclopentylsulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide
CID 7825678
N-(4-aminophenyl)-2-(3-methylcyclohexyl)sulfanylpropanamide
CID 62722965
(2R)-2-cyclohexylsulfanyl-N-(9,10-dioxoanthracen-2-yl)propanamide
CID 8705633
[(2S)-1-(4-carbamoylanilino)-1-oxopropan-2-yl] cyclohexanecarboxylate
CID 40609067
N-phenyl-2-piperidin-3-ylsulfanylpropanamide
CID 84754961
4-[[(2S)-2-(4-acetamidophenyl)sulfanylpropanoyl]amino]benzamide
CID 7999917
(2S)-2-cyclopentylsulfanyl-N-(4-morpholin-4-ylsulfonylphenyl)propanamide
CID 7398211

Frequently Asked Questions

What is the IUPAC name of 4-[[(2R)-2-cyclopentylsulfanylpropanoyl]amino]benzamide?
The IUPAC name of 4-[[(2R)-2-cyclopentylsulfanylpropanoyl]amino]benzamide (CID 7825696) is 4-[[(2R)-2-cyclopentylsulfanylpropanoyl]amino]benzamide.
What is the SMILES notation for 4-[[(2R)-2-cyclopentylsulfanylpropanoyl]amino]benzamide?
The canonical SMILES for 4-[[(2R)-2-cyclopentylsulfanylpropanoyl]amino]benzamide is C[C@@H](SC1CCCC1)C(=O)Nc1ccc(C(N)=O)cc1.
What is the InChIKey of 4-[[(2R)-2-cyclopentylsulfanylpropanoyl]amino]benzamide?
The InChIKey is CJXNRRLVXKYEKY-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H20N2O2S/c1-10(20-13-4-2-3-5-13)15(19)17-12-8-6-11(7-9-12)14(16)18/h6-10,13H,2-5H2,1H3,(H2,16,18)(H,17,19)/t10-/m1/s1.
What are the key properties of 4-[[(2R)-2-cyclopentylsulfanylpropanoyl]amino]benzamide?
4-[[(2R)-2-cyclopentylsulfanylpropanoyl]amino]benzamide has a molecular weight of 292.40 g/mol, XLogP of 2.79, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(2R)-2-cyclopentylsulfanylpropanoyl]amino]benzamide is sourced from PubChem (CID 7825696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).