1-cyclopropyl-N-piperidin-1-ylsulfonylpyrrole-2-carboxamide

C13H19N3O3S — CID 84597196

IUPAC1-cyclopropyl-N-piperidin-1-ylsulfonylpyrrole-2-carboxamide
SMILESO=C(NS(=O)(=O)N1CCCCC1)c1cccn1C1CC1
InChIInChI=1S/C13H19N3O3S/c17-13(12-5-4-10-16(12)11-6-7-11)14-20(18,19)15-8-2-1-3-9-15/h4-5,10-11H,1-3,6-9H2,(H,14,17)
InChIKeyFGCPLNPFMHKRMO-UHFFFAOYSA-N
MW297.38 g/mol
LogP1.28
Rot. Bonds4

About 1-cyclopropyl-N-piperidin-1-ylsulfonylpyrrole-2-carboxamide

1-cyclopropyl-N-piperidin-1-ylsulfonylpyrrole-2-carboxamide (PubChem CID 84597196) has the molecular formula C13H19N3O3S and a molecular weight of 297.38 g/mol. Its IUPAC name is 1-cyclopropyl-N-piperidin-1-ylsulfonylpyrrole-2-carboxamide.

Molecular Properties

Compound Name1-cyclopropyl-N-piperidin-1-ylsulfonylpyrrole-2-carboxamide
PubChem CID84597196
Molecular FormulaC13H19N3O3S
Molecular Weight297.38 g/mol
Exact Mass297.11
IUPAC Name1-cyclopropyl-N-piperidin-1-ylsulfonylpyrrole-2-carboxamide
SMILESO=C(NS(=O)(=O)N1CCCCC1)c1cccn1C1CC1
InChIInChI=1S/C13H19N3O3S/c17-13(12-5-4-10-16(12)11-6-7-11)14-20(18,19)15-8-2-1-3-9-15/h4-5,10-11H,1-3,6-9H2,(H,14,17)
InChIKeyFGCPLNPFMHKRMO-UHFFFAOYSA-N
XLogP1.28
TPSA71.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-piperidin-1-ylsulfonyl-1-propan-2-ylpyrrole-2-carboxamide
CID 75514495
1-cyclopropyl-N-[methyl(propyl)sulfamoyl]pyrrole-2-carboxamide
CID 75499558
1-cyclopropyl-N-ethylpyrrole-2-carboxamide
CID 130688583
1-cyclopropyl-N-(2-hydroxyethyl)pyrrole-2-carboxamide
CID 43639342
1-cyclopropyl-N-(2-sulfamoylphenyl)pyrrole-2-carboxamide
CID 61131105
1-cyclobutyl-N-(2-hydroxycycloheptyl)pyrrole-2-carboxamide
CID 114609767
4-[(1-cyclopropylpyrrole-2-carbonyl)amino]benzoic acid
CID 43639269
1-cyclopropyl-N-(pyrrolidin-2-ylmethyl)pyrrole-2-carboxamide
CID 62541280
1-cyclopropyl-N-[(2S)-2-hydroxypropyl]pyrrole-2-carboxamide
CID 83058739
N-(2-amino-2-methylpropyl)-1-cyclopropylpyrrole-2-carboxamide
CID 115303317
1-cyclobutyl-N-(4-iodophenyl)pyrrole-2-carboxamide
CID 114609194
1-cyclopropyl-N-(3-hydroxyphenyl)pyrrole-2-carboxamide
CID 43639337

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-piperidin-1-ylsulfonylpyrrole-2-carboxamide?
The IUPAC name of 1-cyclopropyl-N-piperidin-1-ylsulfonylpyrrole-2-carboxamide (CID 84597196) is 1-cyclopropyl-N-piperidin-1-ylsulfonylpyrrole-2-carboxamide.
What is the SMILES notation for 1-cyclopropyl-N-piperidin-1-ylsulfonylpyrrole-2-carboxamide?
The canonical SMILES for 1-cyclopropyl-N-piperidin-1-ylsulfonylpyrrole-2-carboxamide is O=C(NS(=O)(=O)N1CCCCC1)c1cccn1C1CC1.
What is the InChIKey of 1-cyclopropyl-N-piperidin-1-ylsulfonylpyrrole-2-carboxamide?
The InChIKey is FGCPLNPFMHKRMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3S/c17-13(12-5-4-10-16(12)11-6-7-11)14-20(18,19)15-8-2-1-3-9-15/h4-5,10-11H,1-3,6-9H2,(H,14,17).
What are the key properties of 1-cyclopropyl-N-piperidin-1-ylsulfonylpyrrole-2-carboxamide?
1-cyclopropyl-N-piperidin-1-ylsulfonylpyrrole-2-carboxamide has a molecular weight of 297.38 g/mol, XLogP of 1.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-piperidin-1-ylsulfonylpyrrole-2-carboxamide is sourced from PubChem (CID 84597196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).