2-chloro-N-[(3-methylcyclopentyl)methyl]-5-sulfamoylbenzamide

C14H19ClN2O3S — CID 107415687

IUPAC2-chloro-N-[(3-methylcyclopentyl)methyl]-5-sulfamoylbenzamide
SMILESCC1CCC(CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)C1
InChIInChI=1S/C14H19ClN2O3S/c1-9-2-3-10(6-9)8-17-14(18)12-7-11(21(16,19)20)4-5-13(12)15/h4-5,7,9-10H,2-3,6,8H2,1H3,(H,17,18)(H2,16,19,20)
InChIKeyUZOVUVOAVVPZJE-UHFFFAOYSA-N
MW330.84 g/mol
LogP2.15
Rot. Bonds4

About 2-chloro-N-[(3-methylcyclopentyl)methyl]-5-sulfamoylbenzamide

2-chloro-N-[(3-methylcyclopentyl)methyl]-5-sulfamoylbenzamide (PubChem CID 107415687) has the molecular formula C14H19ClN2O3S and a molecular weight of 330.84 g/mol. Its IUPAC name is 2-chloro-N-[(3-methylcyclopentyl)methyl]-5-sulfamoylbenzamide.

Molecular Properties

Compound Name2-chloro-N-[(3-methylcyclopentyl)methyl]-5-sulfamoylbenzamide
PubChem CID107415687
Molecular FormulaC14H19ClN2O3S
Molecular Weight330.84 g/mol
Exact Mass330.08
IUPAC Name2-chloro-N-[(3-methylcyclopentyl)methyl]-5-sulfamoylbenzamide
SMILESCC1CCC(CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)C1
InChIInChI=1S/C14H19ClN2O3S/c1-9-2-3-10(6-9)8-17-14(18)12-7-11(21(16,19)20)4-5-13(12)15/h4-5,7,9-10H,2-3,6,8H2,1H3,(H,17,18)(H2,16,19,20)
InChIKeyUZOVUVOAVVPZJE-UHFFFAOYSA-N
XLogP2.15
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.84
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopropylmethyl)-2-fluoro-5-sulfamoylbenzamide
CID 60727294
3-bromo-N-[(3-methylcyclopentyl)methyl]-5-sulfamoylbenzamide
CID 107414855
2-chloro-N-(2-methylpropyl)-5-sulfamoylbenzamide
CID 47101886
4-chloro-3-(cyclohexylmethylcarbamoyl)benzenesulfonyl chloride
CID 65371129
2-chloro-N-(2-methoxyethyl)-5-sulfamoylbenzamide
CID 47101010
3-chloro-6-(ethylamino)-N-[(3-methylcyclopentyl)methyl]pyridine-2-carboxamide
CID 107415196
5-amino-2-chloro-N-(cyclohexylmethyl)benzamide
CID 43371364
5-amino-2-chloro-N-[(4-hydroxycyclohexyl)methyl]benzamide
CID 106119078
[2-(cyclohexylmethylamino)-2-oxoethyl] 2-chloro-5-sulfamoylbenzoate
CID 7994086
5-chloro-N-[(3-methylcyclopentyl)methyl]furan-2-carboxamide
CID 107413499
5-bromo-2-chloro-N-[(3-chlorocyclopentyl)methyl]benzamide
CID 106126328
4-hydrazinyl-2-methyl-N-[(3-methylcyclopentyl)methyl]benzamide
CID 107415330

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[(3-methylcyclopentyl)methyl]-5-sulfamoylbenzamide?
The IUPAC name of 2-chloro-N-[(3-methylcyclopentyl)methyl]-5-sulfamoylbenzamide (CID 107415687) is 2-chloro-N-[(3-methylcyclopentyl)methyl]-5-sulfamoylbenzamide.
What is the SMILES notation for 2-chloro-N-[(3-methylcyclopentyl)methyl]-5-sulfamoylbenzamide?
The canonical SMILES for 2-chloro-N-[(3-methylcyclopentyl)methyl]-5-sulfamoylbenzamide is CC1CCC(CNC(=O)c2cc(S(N)(=O)=O)ccc2Cl)C1.
What is the InChIKey of 2-chloro-N-[(3-methylcyclopentyl)methyl]-5-sulfamoylbenzamide?
The InChIKey is UZOVUVOAVVPZJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19ClN2O3S/c1-9-2-3-10(6-9)8-17-14(18)12-7-11(21(16,19)20)4-5-13(12)15/h4-5,7,9-10H,2-3,6,8H2,1H3,(H,17,18)(H2,16,19,20).
What are the key properties of 2-chloro-N-[(3-methylcyclopentyl)methyl]-5-sulfamoylbenzamide?
2-chloro-N-[(3-methylcyclopentyl)methyl]-5-sulfamoylbenzamide has a molecular weight of 330.84 g/mol, XLogP of 2.15, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[(3-methylcyclopentyl)methyl]-5-sulfamoylbenzamide is sourced from PubChem (CID 107415687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).