5-cyano-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide

C11H14N2O3S2 — CID 114178763

IUPAC5-cyano-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide
SMILESN#Cc1ccc(S(=O)(=O)NC2CCCC2CO)s1
InChIInChI=1S/C11H14N2O3S2/c12-6-9-4-5-11(17-9)18(15,16)13-10-3-1-2-8(10)7-14/h4-5,8,10,13-14H,1-3,7H2
InChIKeyHUQWHYORUPYNCW-UHFFFAOYSA-N
MW286.38 g/mol
LogP1.06
Rot. Bonds4

About 5-cyano-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide

5-cyano-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide (PubChem CID 114178763) has the molecular formula C11H14N2O3S2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 5-cyano-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-cyano-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide
PubChem CID114178763
Molecular FormulaC11H14N2O3S2
Molecular Weight286.38 g/mol
Exact Mass286.04
IUPAC Name5-cyano-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide
SMILESN#Cc1ccc(S(=O)(=O)NC2CCCC2CO)s1
InChIInChI=1S/C11H14N2O3S2/c12-6-9-4-5-11(17-9)18(15,16)13-10-3-1-2-8(10)7-14/h4-5,8,10,13-14H,1-3,7H2
InChIKeyHUQWHYORUPYNCW-UHFFFAOYSA-N
XLogP1.06
TPSA90.19 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(hydroxymethyl)cyclopentyl]-5-methylthiophene-2-sulfonamide
CID 113318676
2-[5-[[2-(hydroxymethyl)cyclopentyl]sulfamoyl]thiophen-2-yl]acetic acid
CID 106359332
5-cyano-N-[(2-hydroxycyclopentyl)methyl]thiophene-2-sulfonamide
CID 106268476
5-cyano-N-(3-methylcyclohexyl)thiophene-2-sulfonamide
CID 106267297
5-cyano-N-(cyclopentylmethyl)thiophene-2-sulfonamide
CID 106267298
4-ethyl-N-[2-(hydroxymethyl)cyclopentyl]benzenesulfonamide
CID 103835956
5-cyano-N-(1,1-dioxothian-4-yl)thiophene-2-sulfonamide
CID 106267400
5-[[2-(hydroxymethyl)cyclopentyl]sulfamoyl]-3-methylthiophene-2-carboxylic acid
CID 106359339
5-cyano-N-cyclohex-3-en-1-ylthiophene-2-sulfonamide
CID 106269472
5-cyano-N-(3,3,5,5-tetramethylcyclohexyl)thiophene-2-sulfonamide
CID 106268895
3-bromo-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide
CID 103835912
5-cyano-N-(4-propylcyclohexyl)thiophene-2-sulfonamide
CID 106267728

Frequently Asked Questions

What is the IUPAC name of 5-cyano-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide?
The IUPAC name of 5-cyano-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide (CID 114178763) is 5-cyano-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-cyano-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-cyano-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide is N#Cc1ccc(S(=O)(=O)NC2CCCC2CO)s1.
What is the InChIKey of 5-cyano-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide?
The InChIKey is HUQWHYORUPYNCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O3S2/c12-6-9-4-5-11(17-9)18(15,16)13-10-3-1-2-8(10)7-14/h4-5,8,10,13-14H,1-3,7H2.
What are the key properties of 5-cyano-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide?
5-cyano-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide has a molecular weight of 286.38 g/mol, XLogP of 1.06, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-N-[2-(hydroxymethyl)cyclopentyl]thiophene-2-sulfonamide is sourced from PubChem (CID 114178763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).