N-(5-fluoro-2-sulfamoylphenyl)-2,2-dimethylcyclopentane-1-carboxamide

C14H19FN2O3S — CID 107182877

IUPACN-(5-fluoro-2-sulfamoylphenyl)-2,2-dimethylcyclopentane-1-carboxamide
SMILESCC1(C)CCCC1C(=O)Nc1cc(F)ccc1S(N)(=O)=O
InChIInChI=1S/C14H19FN2O3S/c1-14(2)7-3-4-10(14)13(18)17-11-8-9(15)5-6-12(11)21(16,19)20/h5-6,8,10H,3-4,7H2,1-2H3,(H,17,18)(H2,16,19,20)
InChIKeyFPRUJWGINWHOEO-UHFFFAOYSA-N
MW314.38 g/mol
LogP2.24
Rot. Bonds3

About N-(5-fluoro-2-sulfamoylphenyl)-2,2-dimethylcyclopentane-1-carboxamide

N-(5-fluoro-2-sulfamoylphenyl)-2,2-dimethylcyclopentane-1-carboxamide (PubChem CID 107182877) has the molecular formula C14H19FN2O3S and a molecular weight of 314.38 g/mol. Its IUPAC name is N-(5-fluoro-2-sulfamoylphenyl)-2,2-dimethylcyclopentane-1-carboxamide.

Molecular Properties

Compound NameN-(5-fluoro-2-sulfamoylphenyl)-2,2-dimethylcyclopentane-1-carboxamide
PubChem CID107182877
Molecular FormulaC14H19FN2O3S
Molecular Weight314.38 g/mol
Exact Mass314.11
IUPAC NameN-(5-fluoro-2-sulfamoylphenyl)-2,2-dimethylcyclopentane-1-carboxamide
SMILESCC1(C)CCCC1C(=O)Nc1cc(F)ccc1S(N)(=O)=O
InChIInChI=1S/C14H19FN2O3S/c1-14(2)7-3-4-10(14)13(18)17-11-8-9(15)5-6-12(11)21(16,19)20/h5-6,8,10H,3-4,7H2,1-2H3,(H,17,18)(H2,16,19,20)
InChIKeyFPRUJWGINWHOEO-UHFFFAOYSA-N
XLogP2.24
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.38
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2,2-dimethylcyclopentanecarbonyl)amino]-4-fluorobenzoic acid
CID 107175114
N-(4-fluoro-2-iodophenyl)-2,2-dimethylcyclopentane-1-carboxamide
CID 104918053
N-(5-fluoro-2-sulfamoylphenyl)cyclohex-3-ene-1-carboxamide
CID 61130912
N-[4-(aminomethyl)-2-fluorophenyl]-2,2-dimethylcyclopentane-1-carboxamide
CID 107174661
N-(2-bromo-4-methylphenyl)-2,2-dimethylcyclopentane-1-carboxamide
CID 104920682
2-bromo-4-[(2,2-dimethylcyclopentanecarbonyl)amino]benzenesulfonyl chloride
CID 107176181
(1S)-N-(5-fluoro-2-methylphenyl)-2,2-dimethylcyclopropane-1-carboxamide
CID 137467542
N-(4-amino-2-methoxyphenyl)-2,2-dimethylcyclopentane-1-carboxamide
CID 107174704
5-[(2,2-dimethylcyclopentanecarbonyl)amino]-2,4-difluorobenzoic acid
CID 107175258
N-[4-(aminomethyl)-2-fluorophenyl]-2,2-dimethylcyclohexane-1-carboxamide
CID 107174662
N-(5-fluoro-2-sulfamoylphenyl)butanamide
CID 61130555
2-amino-N-(2,2-dimethylcyclopentyl)-4-fluorobenzenesulfonamide
CID 79861785

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-sulfamoylphenyl)-2,2-dimethylcyclopentane-1-carboxamide?
The IUPAC name of N-(5-fluoro-2-sulfamoylphenyl)-2,2-dimethylcyclopentane-1-carboxamide (CID 107182877) is N-(5-fluoro-2-sulfamoylphenyl)-2,2-dimethylcyclopentane-1-carboxamide.
What is the SMILES notation for N-(5-fluoro-2-sulfamoylphenyl)-2,2-dimethylcyclopentane-1-carboxamide?
The canonical SMILES for N-(5-fluoro-2-sulfamoylphenyl)-2,2-dimethylcyclopentane-1-carboxamide is CC1(C)CCCC1C(=O)Nc1cc(F)ccc1S(N)(=O)=O.
What is the InChIKey of N-(5-fluoro-2-sulfamoylphenyl)-2,2-dimethylcyclopentane-1-carboxamide?
The InChIKey is FPRUJWGINWHOEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN2O3S/c1-14(2)7-3-4-10(14)13(18)17-11-8-9(15)5-6-12(11)21(16,19)20/h5-6,8,10H,3-4,7H2,1-2H3,(H,17,18)(H2,16,19,20).
What are the key properties of N-(5-fluoro-2-sulfamoylphenyl)-2,2-dimethylcyclopentane-1-carboxamide?
N-(5-fluoro-2-sulfamoylphenyl)-2,2-dimethylcyclopentane-1-carboxamide has a molecular weight of 314.38 g/mol, XLogP of 2.24, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-sulfamoylphenyl)-2,2-dimethylcyclopentane-1-carboxamide is sourced from PubChem (CID 107182877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).