N-[(3-sulfamoylphenyl)methyl]piperidine-4-carboxamide

C13H19N3O3S — CID 60857668

IUPACN-[(3-sulfamoylphenyl)methyl]piperidine-4-carboxamide
SMILESNS(=O)(=O)c1cccc(CNC(=O)C2CCNCC2)c1
InChIInChI=1S/C13H19N3O3S/c14-20(18,19)12-3-1-2-10(8-12)9-16-13(17)11-4-6-15-7-5-11/h1-3,8,11,15H,4-7,9H2,(H,16,17)(H2,14,18,19)
InChIKeyOPIFNCHGBAXDDH-UHFFFAOYSA-N
MW297.38 g/mol
LogP-0.05
Rot. Bonds4

About N-[(3-sulfamoylphenyl)methyl]piperidine-4-carboxamide

N-[(3-sulfamoylphenyl)methyl]piperidine-4-carboxamide (PubChem CID 60857668) has the molecular formula C13H19N3O3S and a molecular weight of 297.38 g/mol. Its IUPAC name is N-[(3-sulfamoylphenyl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[(3-sulfamoylphenyl)methyl]piperidine-4-carboxamide
PubChem CID60857668
Molecular FormulaC13H19N3O3S
Molecular Weight297.38 g/mol
Exact Mass297.11
IUPAC NameN-[(3-sulfamoylphenyl)methyl]piperidine-4-carboxamide
SMILESNS(=O)(=O)c1cccc(CNC(=O)C2CCNCC2)c1
InChIInChI=1S/C13H19N3O3S/c14-20(18,19)12-3-1-2-10(8-12)9-16-13(17)11-4-6-15-7-5-11/h1-3,8,11,15H,4-7,9H2,(H,16,17)(H2,14,18,19)
InChIKeyOPIFNCHGBAXDDH-UHFFFAOYSA-N
XLogP-0.05
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 5-0.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-sulfamoylphenyl)methyl]pyrrolidine-3-carboxamide
CID 55150240
N-[(3-sulfamoylphenyl)methyl]cyclopent-3-ene-1-carboxamide
CID 64766763
N-[(3-sulfamoylphenyl)methyl]azepane-2-carboxamide
CID 64562054
N-benzylpiperidine-4-carboxamide
CID 3868064
N-[(3-chlorophenyl)methyl]piperidine-4-carboxamide
CID 16769351
N-[(3-sulfamoylphenyl)methyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide;hydrochloride
CID 119293676
2-(cyclopropylmethylamino)-N-[(3-sulfamoylphenyl)methyl]acetamide
CID 60859149
N-[[3-(ethylcarbamoyl)phenyl]methyl]piperidine-4-carboxamide
CID 119295612
N-[[3-(cyclopentanecarbonylamino)phenyl]methyl]piperidine-4-carboxamide;hydrochloride
CID 119299314
N-[[3-[(4-methylphenyl)methylcarbamoyl]phenyl]methyl]piperidine-4-carboxamide
CID 119289038
N-[(3-piperidin-1-ylsulfonylphenyl)methyl]piperidine-3-carboxamide
CID 119312856
3-ethyl-N-[(3-sulfamoylphenyl)methyl]pyrrolidine-3-carboxamide
CID 63139949

Frequently Asked Questions

What is the IUPAC name of N-[(3-sulfamoylphenyl)methyl]piperidine-4-carboxamide?
The IUPAC name of N-[(3-sulfamoylphenyl)methyl]piperidine-4-carboxamide (CID 60857668) is N-[(3-sulfamoylphenyl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for N-[(3-sulfamoylphenyl)methyl]piperidine-4-carboxamide?
The canonical SMILES for N-[(3-sulfamoylphenyl)methyl]piperidine-4-carboxamide is NS(=O)(=O)c1cccc(CNC(=O)C2CCNCC2)c1.
What is the InChIKey of N-[(3-sulfamoylphenyl)methyl]piperidine-4-carboxamide?
The InChIKey is OPIFNCHGBAXDDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3S/c14-20(18,19)12-3-1-2-10(8-12)9-16-13(17)11-4-6-15-7-5-11/h1-3,8,11,15H,4-7,9H2,(H,16,17)(H2,14,18,19).
What are the key properties of N-[(3-sulfamoylphenyl)methyl]piperidine-4-carboxamide?
N-[(3-sulfamoylphenyl)methyl]piperidine-4-carboxamide has a molecular weight of 297.38 g/mol, XLogP of -0.05, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-sulfamoylphenyl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 60857668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).