N-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]methanesulfinamide

C7H15NO2S — CID 130631227

IUPACN-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]methanesulfinamide
SMILESCS(=O)N[C@@H]1CCC[C@@H]1CO
InChIInChI=1S/C7H15NO2S/c1-11(10)8-7-4-2-3-6(7)5-9/h6-9H,2-5H2,1H3/t6-,7-,11?/m1/s1
InChIKeyNSVYXVRIGPZRBM-CZGZLPJCSA-N
MW177.27 g/mol
LogP0.03
Rot. Bonds3

About N-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]methanesulfinamide

N-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]methanesulfinamide (PubChem CID 130631227) has the molecular formula C7H15NO2S and a molecular weight of 177.27 g/mol. Its IUPAC name is N-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]methanesulfinamide.

Molecular Properties

Compound NameN-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]methanesulfinamide
PubChem CID130631227
Molecular FormulaC7H15NO2S
Molecular Weight177.27 g/mol
Exact Mass177.08
IUPAC NameN-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]methanesulfinamide
SMILESCS(=O)N[C@@H]1CCC[C@@H]1CO
InChIInChI=1S/C7H15NO2S/c1-11(10)8-7-4-2-3-6(7)5-9/h6-9H,2-5H2,1H3/t6-,7-,11?/m1/s1
InChIKeyNSVYXVRIGPZRBM-CZGZLPJCSA-N
XLogP0.03
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.27
LogP ≤ 50.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[(1S)-2-(methylamino)cyclopentyl]methanol
CID 123545278
N-[2-(hydroxymethyl)cyclopentyl]methanesulfonamide
CID 103697796
[(1R,2S)-2-(hydroxymethyl)cyclopentyl]urea
CID 131092066
methyl N-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]carbamate
CID 130640113
3-[[2-(hydroxymethyl)cyclopentyl]amino]-2-methylbutanoic acid
CID 106360781
[2-(cyclopropylamino)cyclopentyl]methanol
CID 83863384
N-[2-(hydroxymethyl)cyclopentyl]-2,2-dimethylpropanamide
CID 103751419
N-[2-(hydroxymethyl)cyclopentyl]-3-sulfanylpropanamide
CID 106367884
2-[[(1R,2S)-2-(hydroxymethyl)cyclopentyl]amino]ethanol
CID 131230127
N-[2-(hydroxymethyl)cyclopentyl]-3-methylsulfonylpropanamide
CID 103822602
N-[2-(hydroxymethyl)cyclopentyl]nonanamide
CID 103774038
2-cyclohexyl-N-[2-(hydroxymethyl)cyclopentyl]acetamide
CID 103751275

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]methanesulfinamide?
The IUPAC name of N-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]methanesulfinamide (CID 130631227) is N-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]methanesulfinamide.
What is the SMILES notation for N-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]methanesulfinamide?
The canonical SMILES for N-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]methanesulfinamide is CS(=O)N[C@@H]1CCC[C@@H]1CO.
What is the InChIKey of N-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]methanesulfinamide?
The InChIKey is NSVYXVRIGPZRBM-CZGZLPJCSA-N. The full InChI is InChI=1S/C7H15NO2S/c1-11(10)8-7-4-2-3-6(7)5-9/h6-9H,2-5H2,1H3/t6-,7-,11?/m1/s1.
What are the key properties of N-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]methanesulfinamide?
N-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]methanesulfinamide has a molecular weight of 177.27 g/mol, XLogP of 0.03, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2S)-2-(hydroxymethyl)cyclopentyl]methanesulfinamide is sourced from PubChem (CID 130631227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).