N-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide

C14H21N3O3S — CID 114612168

IUPACN-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide
SMILESNS(=O)(=O)c1cc(C(=O)NCC2CCCC2)n(C2CC2)c1
InChIInChI=1S/C14H21N3O3S/c15-21(19,20)12-7-13(17(9-12)11-5-6-11)14(18)16-8-10-3-1-2-4-10/h7,9-11H,1-6,8H2,(H,16,18)(H2,15,19,20)
InChIKeyOWCUDJTWJWTRFY-UHFFFAOYSA-N
MW311.41 g/mol
LogP1.39
Rot. Bonds5

About N-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide

N-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide (PubChem CID 114612168) has the molecular formula C14H21N3O3S and a molecular weight of 311.41 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide
PubChem CID114612168
Molecular FormulaC14H21N3O3S
Molecular Weight311.41 g/mol
Exact Mass311.13
IUPAC NameN-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide
SMILESNS(=O)(=O)c1cc(C(=O)NCC2CCCC2)n(C2CC2)c1
InChIInChI=1S/C14H21N3O3S/c15-21(19,20)12-7-13(17(9-12)11-5-6-11)14(18)16-8-10-3-1-2-4-10/h7,9-11H,1-6,8H2,(H,16,18)(H2,15,19,20)
InChIKeyOWCUDJTWJWTRFY-UHFFFAOYSA-N
XLogP1.39
TPSA94.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.41
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide
CID 114611983
4-amino-N-(cyclohexylmethyl)-1-cyclopropylpyrrole-2-carboxamide
CID 43643527
1-cyclopropyl-N-methyl-4-sulfamoylpyrrole-2-carboxamide
CID 114611999
1-cyclopropyl-N-(3-methylbutyl)-4-sulfamoylpyrrole-2-carboxamide
CID 114611971
methyl 1-cyclopentyl-4-sulfamoylpyrrole-2-carboxylate
CID 114612610
1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide
CID 114612010
methyl 1-cyclobutyl-4-sulfamoylpyrrole-2-carboxylate
CID 114612607
1-cyclobutyl-4-sulfamoylpyrrole-2-carboxylic acid
CID 114612783
1-cyclopropyl-N-(oxan-3-yl)-4-sulfamoylpyrrole-2-carboxamide
CID 114612354
N-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide
CID 114611940
1-cyclopropyl-N-(2-methyloxolan-3-yl)-4-sulfamoylpyrrole-2-carboxamide
CID 114612454
oxetan-3-yl 1-cyclopropyl-4-sulfamoylpyrrole-2-carboxylate
CID 102608651

Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide?
The IUPAC name of N-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide (CID 114612168) is N-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide.
What is the SMILES notation for N-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide?
The canonical SMILES for N-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide is NS(=O)(=O)c1cc(C(=O)NCC2CCCC2)n(C2CC2)c1.
What is the InChIKey of N-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide?
The InChIKey is OWCUDJTWJWTRFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O3S/c15-21(19,20)12-7-13(17(9-12)11-5-6-11)14(18)16-8-10-3-1-2-4-10/h7,9-11H,1-6,8H2,(H,16,18)(H2,15,19,20).
What are the key properties of N-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide?
N-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide has a molecular weight of 311.41 g/mol, XLogP of 1.39, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide is sourced from PubChem (CID 114612168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).