N-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide

C10H19NO4S — CID 103822602

IUPACN-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide
SMILESCS(=O)(=O)CCC(=O)NC1CCCC1CO
InChIInChI=1S/C10H19NO4S/c1-16(14,15)6-5-10(13)11-9-4-2-3-8(9)7-12/h8-9,12H,2-7H2,1H3,(H,11,13)
InChIKeyYTYIEEIPNBFCHF-UHFFFAOYSA-N
MW249.33 g/mol
LogP-0.30
Rot. Bonds5

About N-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide

N-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide (PubChem CID 103822602) has the molecular formula C10H19NO4S and a molecular weight of 249.33 g/mol. Its IUPAC name is N-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide.

Molecular Properties

Compound NameN-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide
PubChem CID103822602
Molecular FormulaC10H19NO4S
Molecular Weight249.33 g/mol
Exact Mass249.10
IUPAC NameN-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide
SMILESCS(=O)(=O)CCC(=O)NC1CCCC1CO
InChIInChI=1S/C10H19NO4S/c1-16(14,15)6-5-10(13)11-9-4-2-3-8(9)7-12/h8-9,12H,2-7H2,1H3,(H,11,13)
InChIKeyYTYIEEIPNBFCHF-UHFFFAOYSA-N
XLogP-0.30
TPSA83.47 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 5-0.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide 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-[2-(hydroxymethyl)cyclopentyl]-3-sulfanylpropanamide
CID 106367884
N-[2-(hydroxymethyl)cyclopentyl]nonanamide
CID 103774038
N-[2-(aminomethyl)cyclohexyl]-4-methylsulfonylbutanamide;hydrochloride
CID 119612520
4-[[2-(hydroxymethyl)cyclohexyl]amino]-4-oxobutanoic acid
CID 106359284
5-chloro-N-[2-(hydroxymethyl)cyclopentyl]pentanamide
CID 106359865
4-chloro-N-[2-(hydroxymethyl)cyclohexyl]butanamide
CID 106359885
N-[2-(hydroxymethyl)cyclopentyl]methanesulfonamide
CID 103697796
3-ethoxy-N-[2-(hydroxymethyl)cyclohexyl]propanamide
CID 103798579
N-[2-(hydroxymethyl)cyclopentyl]-3-piperidin-4-ylpropanamide
CID 103876533
[(1R,2S)-2-(hydroxymethyl)cyclopentyl]urea
CID 131092066
N-[(1S,2R)-2-(hydroxymethyl)cyclohexyl]pent-4-enamide
CID 89374191
N-[2-(hydroxymethyl)cyclohexyl]-2-methylsulfonylpropanamide
CID 103798336

Frequently Asked Questions

What is the IUPAC name of N-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide?
The IUPAC name of N-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide (CID 103822602) is N-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide.
What is the SMILES notation for N-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide?
The canonical SMILES for N-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide is CS(=O)(=O)CCC(=O)NC1CCCC1CO.
What is the InChIKey of N-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide?
The InChIKey is YTYIEEIPNBFCHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO4S/c1-16(14,15)6-5-10(13)11-9-4-2-3-8(9)7-12/h8-9,12H,2-7H2,1H3,(H,11,13).
What are the key properties of N-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide?
N-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide has a molecular weight of 249.33 g/mol, XLogP of -0.30, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide is sourced from PubChem (CID 103822602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).