N-cyclopentyl-2,4-dimethyl-5-sulfamoylbenzamide

C14H20N2O3S — CID 47469038

IUPACN-cyclopentyl-2,4-dimethyl-5-sulfamoylbenzamide
SMILESCc1cc(C)c(S(N)(=O)=O)cc1C(=O)NC1CCCC1
InChIInChI=1S/C14H20N2O3S/c1-9-7-10(2)13(20(15,18)19)8-12(9)14(17)16-11-5-3-4-6-11/h7-8,11H,3-6H2,1-2H3,(H,16,17)(H2,15,18,19)
InChIKeyPINLCLWWXSBEAF-UHFFFAOYSA-N
MW296.39 g/mol
LogP1.62
Rot. Bonds3

About N-cyclopentyl-2,4-dimethyl-5-sulfamoylbenzamide

N-cyclopentyl-2,4-dimethyl-5-sulfamoylbenzamide (PubChem CID 47469038) has the molecular formula C14H20N2O3S and a molecular weight of 296.39 g/mol. Its IUPAC name is N-cyclopentyl-2,4-dimethyl-5-sulfamoylbenzamide.

Molecular Properties

Compound NameN-cyclopentyl-2,4-dimethyl-5-sulfamoylbenzamide
PubChem CID47469038
Molecular FormulaC14H20N2O3S
Molecular Weight296.39 g/mol
Exact Mass296.12
IUPAC NameN-cyclopentyl-2,4-dimethyl-5-sulfamoylbenzamide
SMILESCc1cc(C)c(S(N)(=O)=O)cc1C(=O)NC1CCCC1
InChIInChI=1S/C14H20N2O3S/c1-9-7-10(2)13(20(15,18)19)8-12(9)14(17)16-11-5-3-4-6-11/h7-8,11H,3-6H2,1-2H3,(H,16,17)(H2,15,18,19)
InChIKeyPINLCLWWXSBEAF-UHFFFAOYSA-N
XLogP1.62
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-5-fluoro-2-methyl-3-sulfamoylbenzamide
CID 65373979
2,4-dimethyl-N-(2-methylbutan-2-yl)-5-sulfamoylbenzamide
CID 62922364
N-cyclohexyl-5-methyl-4-sulfamoylfuran-2-carboxamide
CID 65374556
2,4-dimethyl-N-(2-methylsulfonylethyl)-5-sulfamoylbenzamide
CID 62045621
N-cycloheptyl-4-hydrazinyl-2-methylbenzamide
CID 113400294
2,4-dimethyl-N-[2-(4-methylpiperidin-1-yl)ethyl]-5-sulfamoylbenzamide
CID 51127734
4-chloro-N-cyclohexyl-2-cyclohexylsulfonyl-5-sulfamoylbenzamide
CID 126508892
5-chloro-N-cyclopentyl-2-methoxy-3-sulfamoylbenzamide
CID 65374998
N-cyclohexyl-2,5-dimethylbenzamide
CID 925443
N-cyclopentyl-7-methyl-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 110763647
N-cyclobutyl-5-methyl-4-sulfamoylfuran-2-carboxamide
CID 65389029
5-chloro-N-cyclopropyl-2-methyl-3-sulfamoylbenzamide
CID 82891438

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2,4-dimethyl-5-sulfamoylbenzamide?
The IUPAC name of N-cyclopentyl-2,4-dimethyl-5-sulfamoylbenzamide (CID 47469038) is N-cyclopentyl-2,4-dimethyl-5-sulfamoylbenzamide.
What is the SMILES notation for N-cyclopentyl-2,4-dimethyl-5-sulfamoylbenzamide?
The canonical SMILES for N-cyclopentyl-2,4-dimethyl-5-sulfamoylbenzamide is Cc1cc(C)c(S(N)(=O)=O)cc1C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2,4-dimethyl-5-sulfamoylbenzamide?
The InChIKey is PINLCLWWXSBEAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3S/c1-9-7-10(2)13(20(15,18)19)8-12(9)14(17)16-11-5-3-4-6-11/h7-8,11H,3-6H2,1-2H3,(H,16,17)(H2,15,18,19).
What are the key properties of N-cyclopentyl-2,4-dimethyl-5-sulfamoylbenzamide?
N-cyclopentyl-2,4-dimethyl-5-sulfamoylbenzamide has a molecular weight of 296.39 g/mol, XLogP of 1.62, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2,4-dimethyl-5-sulfamoylbenzamide is sourced from PubChem (CID 47469038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).