N-cyclopentyl-2-methylsulfanylpropanamide

C9H17NOS — CID 126996006

IUPACN-cyclopentyl-2-methylsulfanylpropanamide
SMILESCSC(C)C(=O)NC1CCCC1
InChIInChI=1S/C9H17NOS/c1-7(12-2)9(11)10-8-5-3-4-6-8/h7-8H,3-6H2,1-2H3,(H,10,11)
InChIKeyWSYOCVABXBCKJI-UHFFFAOYSA-N
MW187.31 g/mol
LogP1.80
Rot. Bonds3

About N-cyclopentyl-2-methylsulfanylpropanamide

N-cyclopentyl-2-methylsulfanylpropanamide (PubChem CID 126996006) has the molecular formula C9H17NOS and a molecular weight of 187.31 g/mol. Its IUPAC name is N-cyclopentyl-2-methylsulfanylpropanamide.

Molecular Properties

Compound NameN-cyclopentyl-2-methylsulfanylpropanamide
PubChem CID126996006
Molecular FormulaC9H17NOS
Molecular Weight187.31 g/mol
Exact Mass187.10
IUPAC NameN-cyclopentyl-2-methylsulfanylpropanamide
SMILESCSC(C)C(=O)NC1CCCC1
InChIInChI=1S/C9H17NOS/c1-7(12-2)9(11)10-8-5-3-4-6-8/h7-8H,3-6H2,1-2H3,(H,10,11)
InChIKeyWSYOCVABXBCKJI-UHFFFAOYSA-N
XLogP1.80
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.31
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-cyclopentyl-2-methylsulfanylpropanamide 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

(2R)-N-(cyclohexylcarbamoyl)-2-methylsulfanylpropanamide
CID 94157804
N-cyclohexyl-2-silylpropanamide
CID 123581134
1-cyclopentyl-3-[(1R)-1-methylsulfanylethyl]urea
CID 149014671
2-(2-aminopropylsulfanyl)-N-cyclopentylpropanamide
CID 66219669
2-[1-(cyclohexylamino)-1-oxopropan-2-yl]sulfanylacetic acid
CID 43082977
N-cyclopentyl-2-(2-methylsulfanylpropanoylamino)benzamide
CID 43077712
N-[1-[2-(cyclopropylamino)-2-oxoethyl]piperidin-4-yl]-2-methylsulfanylpropanamide
CID 47057659
N-cyclopentyl-2-(methylamino)propanamide
CID 43083499
(2S)-N-cyclopentyl-2-(methylamino)propanamide
CID 28827015
(2S)-N-cyclopentyl-2-[[5-[(2R)-1-(cyclopentylamino)-1-oxopropan-2-yl]sulfanyl-1,3,4-thiadiazol-2-yl]sulfanyl]propanamide
CID 25442332
1-[(2R)-2-methylsulfanylpropanoyl]-N-[4-[[(2R)-2-methylsulfanylpropanoyl]amino]cyclohexyl]piperidine-4-carboxamide
CID 95784499
(2R)-2-amino-3-[1-(cyclopentylamino)-1-oxopropan-2-yl]sulfanyl-3-methylbutanoic acid
CID 114189225

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-methylsulfanylpropanamide?
The IUPAC name of N-cyclopentyl-2-methylsulfanylpropanamide (CID 126996006) is N-cyclopentyl-2-methylsulfanylpropanamide.
What is the SMILES notation for N-cyclopentyl-2-methylsulfanylpropanamide?
The canonical SMILES for N-cyclopentyl-2-methylsulfanylpropanamide is CSC(C)C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-methylsulfanylpropanamide?
The InChIKey is WSYOCVABXBCKJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NOS/c1-7(12-2)9(11)10-8-5-3-4-6-8/h7-8H,3-6H2,1-2H3,(H,10,11).
What are the key properties of N-cyclopentyl-2-methylsulfanylpropanamide?
N-cyclopentyl-2-methylsulfanylpropanamide has a molecular weight of 187.31 g/mol, XLogP of 1.80, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-methylsulfanylpropanamide is sourced from PubChem (CID 126996006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).