4-[(4-methylphenyl)sulfonylamino]-N-phenylpiperidine-1-carboxamide

C19H23N3O3S — CID 46380328

IUPAC4-[(4-methylphenyl)sulfonylamino]-N-phenylpiperidine-1-carboxamide
SMILESCc1ccc(S(=O)(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)cc1
InChIInChI=1S/C19H23N3O3S/c1-15-7-9-18(10-8-15)26(24,25)21-17-11-13-22(14-12-17)19(23)20-16-5-3-2-4-6-16/h2-10,17,21H,11-14H2,1H3,(H,20,23)
InChIKeyDRKCEIUDOBBFFJ-UHFFFAOYSA-N
MW373.48 g/mol
LogP2.97
Rot. Bonds4

About 4-[(4-methylphenyl)sulfonylamino]-N-phenylpiperidine-1-carboxamide

4-[(4-methylphenyl)sulfonylamino]-N-phenylpiperidine-1-carboxamide (PubChem CID 46380328) has the molecular formula C19H23N3O3S and a molecular weight of 373.48 g/mol. Its IUPAC name is 4-[(4-methylphenyl)sulfonylamino]-N-phenylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-[(4-methylphenyl)sulfonylamino]-N-phenylpiperidine-1-carboxamide
PubChem CID46380328
Molecular FormulaC19H23N3O3S
Molecular Weight373.48 g/mol
Exact Mass373.15
IUPAC Name4-[(4-methylphenyl)sulfonylamino]-N-phenylpiperidine-1-carboxamide
SMILESCc1ccc(S(=O)(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)cc1
InChIInChI=1S/C19H23N3O3S/c1-15-7-9-18(10-8-15)26(24,25)21-17-11-13-22(14-12-17)19(23)20-16-5-3-2-4-6-16/h2-10,17,21H,11-14H2,1H3,(H,20,23)
InChIKeyDRKCEIUDOBBFFJ-UHFFFAOYSA-N
XLogP2.97
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.48
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(4-fluorophenyl)sulfonylamino]-N-(4-sulfamoylphenyl)piperidine-1-carboxamide
CID 55647465
N-[2-[4-[(4-methylphenyl)sulfonylamino]piperidin-1-yl]-2-oxoethyl]benzamide
CID 50823425
N-phenyl-4-[[4-(phenylsulfamoyl)benzoyl]amino]piperidine-1-carboxamide
CID 46537325
6-[4-[(4-methylphenyl)sulfonylamino]piperidin-1-yl]-6-oxohexanoic acid
CID 139613522
4-(methanesulfonamido)-N-(3-methylphenyl)piperidine-1-carboxamide
CID 41430122
4-methyl-N-[1-[(2R)-oxolane-2-carbonyl]piperidin-4-yl]benzenesulfonamide
CID 94091179
(3R)-3-anilino-N-(4-methylsulfonylphenyl)pyrrolidine-1-carboxamide
CID 95239711
4-[[4-(butan-2-ylsulfamoyl)benzoyl]amino]-N-phenylpiperidine-1-carboxamide
CID 46700441
4-methyl-N-[1-(3,4,5-trihydroxybenzoyl)piperidin-4-yl]benzenesulfonamide
CID 108564412
1-[[4-(cyclopropylsulfamoyl)phenyl]carbamoyl]-3-methylpyrrolidine-3-carboxylic acid
CID 122085678
N-(4-benzoylphenyl)-4-(propan-2-ylsulfonylamino)piperidine-1-carboxamide
CID 20630393
tert-butyl 4-[[4-[(4-methylphenyl)sulfonylamino]phenyl]sulfonylamino]piperidine-1-carboxylate
CID 169372481

Frequently Asked Questions

What is the IUPAC name of 4-[(4-methylphenyl)sulfonylamino]-N-phenylpiperidine-1-carboxamide?
The IUPAC name of 4-[(4-methylphenyl)sulfonylamino]-N-phenylpiperidine-1-carboxamide (CID 46380328) is 4-[(4-methylphenyl)sulfonylamino]-N-phenylpiperidine-1-carboxamide.
What is the SMILES notation for 4-[(4-methylphenyl)sulfonylamino]-N-phenylpiperidine-1-carboxamide?
The canonical SMILES for 4-[(4-methylphenyl)sulfonylamino]-N-phenylpiperidine-1-carboxamide is Cc1ccc(S(=O)(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)cc1.
What is the InChIKey of 4-[(4-methylphenyl)sulfonylamino]-N-phenylpiperidine-1-carboxamide?
The InChIKey is DRKCEIUDOBBFFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3S/c1-15-7-9-18(10-8-15)26(24,25)21-17-11-13-22(14-12-17)19(23)20-16-5-3-2-4-6-16/h2-10,17,21H,11-14H2,1H3,(H,20,23).
What are the key properties of 4-[(4-methylphenyl)sulfonylamino]-N-phenylpiperidine-1-carboxamide?
4-[(4-methylphenyl)sulfonylamino]-N-phenylpiperidine-1-carboxamide has a molecular weight of 373.48 g/mol, XLogP of 2.97, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-methylphenyl)sulfonylamino]-N-phenylpiperidine-1-carboxamide is sourced from PubChem (CID 46380328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).