N-(2-methyl-4-sulfamoylphenyl)piperidine-1-carboxamide

C13H19N3O3S — CID 79155124

IUPACN-(2-methyl-4-sulfamoylphenyl)piperidine-1-carboxamide
SMILESCc1cc(S(N)(=O)=O)ccc1NC(=O)N1CCCCC1
InChIInChI=1S/C13H19N3O3S/c1-10-9-11(20(14,18)19)5-6-12(10)15-13(17)16-7-3-2-4-8-16/h5-6,9H,2-4,7-8H2,1H3,(H,15,17)(H2,14,18,19)
InChIKeyGLOGENYZPNBRPH-UHFFFAOYSA-N
MW297.38 g/mol
LogP1.66
Rot. Bonds2

About N-(2-methyl-4-sulfamoylphenyl)piperidine-1-carboxamide

N-(2-methyl-4-sulfamoylphenyl)piperidine-1-carboxamide (PubChem CID 79155124) has the molecular formula C13H19N3O3S and a molecular weight of 297.38 g/mol. Its IUPAC name is N-(2-methyl-4-sulfamoylphenyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(2-methyl-4-sulfamoylphenyl)piperidine-1-carboxamide
PubChem CID79155124
Molecular FormulaC13H19N3O3S
Molecular Weight297.38 g/mol
Exact Mass297.11
IUPAC NameN-(2-methyl-4-sulfamoylphenyl)piperidine-1-carboxamide
SMILESCc1cc(S(N)(=O)=O)ccc1NC(=O)N1CCCCC1
InChIInChI=1S/C13H19N3O3S/c1-10-9-11(20(14,18)19)5-6-12(10)15-13(17)16-7-3-2-4-8-16/h5-6,9H,2-4,7-8H2,1H3,(H,15,17)(H2,14,18,19)
InChIKeyGLOGENYZPNBRPH-UHFFFAOYSA-N
XLogP1.66
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-carbamoyl-2-methylphenyl)azocane-1-carboxamide
CID 74244825
N-(4-sulfamoylphenyl)azocane-1-carboxamide
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N-(2-methylphenyl)azepane-1-carboxamide
CID 19165583
N-(2-methyl-4-sulfamoylphenyl)propanamide
CID 43133967
(3S)-3-methoxy-N-(2-methyl-5-sulfamoylphenyl)piperidine-1-carboxamide
CID 125176909
N-(5-bromo-4-fluoro-2-methylphenyl)azepane-1-carboxamide
CID 103274750
N-(2-chloro-4-methylphenyl)azocane-1-carboxamide
CID 17180409
2-cyclobutyl-N-(2-methyl-4-sulfamoylphenyl)acetamide
CID 103164399
2-ethyl-N-(2-methyl-4-sulfamoylphenyl)butanamide
CID 43246558
2-tert-butylsulfanyl-N-(2-methyl-4-sulfamoylphenyl)acetamide
CID 61132847
N-[4-(cyclopentylcarbamoyl)-2-methylphenyl]azepane-1-carboxamide
CID 48645800
N-(2-methyl-4-sulfamoylphenyl)-2,3-dihydro-1,4-dioxine-5-carboxamide
CID 61131286

Frequently Asked Questions

What is the IUPAC name of N-(2-methyl-4-sulfamoylphenyl)piperidine-1-carboxamide?
The IUPAC name of N-(2-methyl-4-sulfamoylphenyl)piperidine-1-carboxamide (CID 79155124) is N-(2-methyl-4-sulfamoylphenyl)piperidine-1-carboxamide.
What is the SMILES notation for N-(2-methyl-4-sulfamoylphenyl)piperidine-1-carboxamide?
The canonical SMILES for N-(2-methyl-4-sulfamoylphenyl)piperidine-1-carboxamide is Cc1cc(S(N)(=O)=O)ccc1NC(=O)N1CCCCC1.
What is the InChIKey of N-(2-methyl-4-sulfamoylphenyl)piperidine-1-carboxamide?
The InChIKey is GLOGENYZPNBRPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O3S/c1-10-9-11(20(14,18)19)5-6-12(10)15-13(17)16-7-3-2-4-8-16/h5-6,9H,2-4,7-8H2,1H3,(H,15,17)(H2,14,18,19).
What are the key properties of N-(2-methyl-4-sulfamoylphenyl)piperidine-1-carboxamide?
N-(2-methyl-4-sulfamoylphenyl)piperidine-1-carboxamide has a molecular weight of 297.38 g/mol, XLogP of 1.66, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methyl-4-sulfamoylphenyl)piperidine-1-carboxamide is sourced from PubChem (CID 79155124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).