4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide

C13H18N2O4S — CID 62522485

IUPAC4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide
SMILESNC(=O)c1ccc(S(=O)(=O)NC2(CO)CCCC2)cc1
InChIInChI=1S/C13H18N2O4S/c14-12(17)10-3-5-11(6-4-10)20(18,19)15-13(9-16)7-1-2-8-13/h3-6,15-16H,1-2,7-9H2,(H2,14,17)
InChIKeyOXRWJXAFPQQEGP-UHFFFAOYSA-N
MW298.36 g/mol
LogP0.37
Rot. Bonds5

About 4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide

4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide (PubChem CID 62522485) has the molecular formula C13H18N2O4S and a molecular weight of 298.36 g/mol. Its IUPAC name is 4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide.

Molecular Properties

Compound Name4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide
PubChem CID62522485
Molecular FormulaC13H18N2O4S
Molecular Weight298.36 g/mol
Exact Mass298.10
IUPAC Name4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide
SMILESNC(=O)c1ccc(S(=O)(=O)NC2(CO)CCCC2)cc1
InChIInChI=1S/C13H18N2O4S/c14-12(17)10-3-5-11(6-4-10)20(18,19)15-13(9-16)7-1-2-8-13/h3-6,15-16H,1-2,7-9H2,(H2,14,17)
InChIKeyOXRWJXAFPQQEGP-UHFFFAOYSA-N
XLogP0.37
TPSA109.49 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.36
LogP ≤ 50.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(4-carbamoylphenyl)sulfonylamino]cyclopentane-1-carboxylic acid
CID 43172930
4-fluoro-N-[1-(hydroxymethyl)cyclohexyl]benzenesulfonamide
CID 62519723
4-(bromomethyl)-N-[1-(hydroxymethyl)cyclopentyl]benzenesulfonamide
CID 65481622
4-ethyl-N-[1-(hydroxymethyl)cyclopentyl]benzenesulfonamide
CID 55082213
4-N-[1-(hydroxymethyl)cyclobutyl]-1-N-methylbenzene-1,4-disulfonamide
CID 115903007
N-[1-(hydroxymethyl)cyclopentyl]-4-propylbenzenesulfonamide
CID 62520894
4-N-[1-(hydroxymethyl)cyclopropyl]-1-N-methylbenzene-1,4-disulfonamide
CID 115902832
2-chloro-5-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzoic acid
CID 62518568
4-acetyl-N-[4-(hydroxymethyl)oxan-4-yl]benzenesulfonamide
CID 106299081
4-[[[1-(hydroxymethyl)cyclopentyl]amino]methyl]benzamide
CID 62522600
2-[1-[(4-iodophenyl)sulfonylamino]cyclohexyl]acetic acid
CID 64700171
N-[1-(hydroxymethyl)cyclopentyl]-6-oxo-1H-pyridine-3-sulfonamide
CID 62521621

Frequently Asked Questions

What is the IUPAC name of 4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide?
The IUPAC name of 4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide (CID 62522485) is 4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide.
What is the SMILES notation for 4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide?
The canonical SMILES for 4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide is NC(=O)c1ccc(S(=O)(=O)NC2(CO)CCCC2)cc1.
What is the InChIKey of 4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide?
The InChIKey is OXRWJXAFPQQEGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O4S/c14-12(17)10-3-5-11(6-4-10)20(18,19)15-13(9-16)7-1-2-8-13/h3-6,15-16H,1-2,7-9H2,(H2,14,17).
What are the key properties of 4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide?
4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide has a molecular weight of 298.36 g/mol, XLogP of 0.37, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-(hydroxymethyl)cyclopentyl]sulfamoyl]benzamide is sourced from PubChem (CID 62522485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).