N-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide

C13H20N4O3S — CID 114611940

IUPACN-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide
SMILESNS(=O)(=O)c1cc(C(=O)NC2CC2)n(C2CCNCC2)c1
InChIInChI=1S/C13H20N4O3S/c14-21(19,20)11-7-12(13(18)16-9-1-2-9)17(8-11)10-3-5-15-6-4-10/h7-10,15H,1-6H2,(H,16,18)(H2,14,19,20)
InChIKeyQZNSJXCTTWQBRL-UHFFFAOYSA-N
MW312.39 g/mol
LogP-0.05
Rot. Bonds4

About N-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide

N-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide (PubChem CID 114611940) has the molecular formula C13H20N4O3S and a molecular weight of 312.39 g/mol. Its IUPAC name is N-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide
PubChem CID114611940
Molecular FormulaC13H20N4O3S
Molecular Weight312.39 g/mol
Exact Mass312.13
IUPAC NameN-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide
SMILESNS(=O)(=O)c1cc(C(=O)NC2CC2)n(C2CCNCC2)c1
InChIInChI=1S/C13H20N4O3S/c14-21(19,20)11-7-12(13(18)16-9-1-2-9)17(8-11)10-3-5-15-6-4-10/h7-10,15H,1-6H2,(H,16,18)(H2,14,19,20)
InChIKeyQZNSJXCTTWQBRL-UHFFFAOYSA-N
XLogP-0.05
TPSA106.22 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.39
LogP ≤ 5-0.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxylate
CID 114612617
1-cyclopropyl-N-(oxan-3-yl)-4-sulfamoylpyrrole-2-carboxamide
CID 114612354
1-cyclopropyl-N-methyl-4-sulfamoylpyrrole-2-carboxamide
CID 114611999
1-cyclopropyl-N-(2-methyloxolan-3-yl)-4-sulfamoylpyrrole-2-carboxamide
CID 114612454
1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide
CID 114612010
methyl 1-cyclopentyl-4-sulfamoylpyrrole-2-carboxylate
CID 114612610
methyl 1-cyclobutyl-4-sulfamoylpyrrole-2-carboxylate
CID 114612607
1-cyclobutyl-4-sulfamoylpyrrole-2-carboxylic acid
CID 114612783
1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide
CID 114611983
1-cyclopropyl-N-(3-methylbutyl)-4-sulfamoylpyrrole-2-carboxamide
CID 114611971
1-cyclopropyl-4-(piperidin-4-ylsulfamoyl)pyrrole-2-carboxylic acid
CID 61403195
N-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide
CID 114612168

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide?
The IUPAC name of N-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide (CID 114611940) is N-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide.
What is the SMILES notation for N-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide?
The canonical SMILES for N-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide is NS(=O)(=O)c1cc(C(=O)NC2CC2)n(C2CCNCC2)c1.
What is the InChIKey of N-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide?
The InChIKey is QZNSJXCTTWQBRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O3S/c14-21(19,20)11-7-12(13(18)16-9-1-2-9)17(8-11)10-3-5-15-6-4-10/h7-10,15H,1-6H2,(H,16,18)(H2,14,19,20).
What are the key properties of N-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide?
N-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide has a molecular weight of 312.39 g/mol, XLogP of -0.05, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide is sourced from PubChem (CID 114611940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).