4-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N-phenylpiperidine-1-carboxamide

C26H34N4O4S — CID 55501544

IUPAC4-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N-phenylpiperidine-1-carboxamide
SMILESCN(C1CCCCC1)S(=O)(=O)c1ccc(C(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)cc1
InChIInChI=1S/C26H34N4O4S/c1-29(23-10-6-3-7-11-23)35(33,34)24-14-12-20(13-15-24)25(31)27-22-16-18-30(19-17-22)26(32)28-21-8-4-2-5-9-21/h2,4-5,8-9,12-15,22-23H,3,6-7,10-11,16-19H2,1H3,(H,27,31)(H,28,32)
InChIKeyWWQDIXSNXAFILM-UHFFFAOYSA-N
MW498.65 g/mol
LogP4.07
Rot. Bonds6

About 4-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N-phenylpiperidine-1-carboxamide

4-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N-phenylpiperidine-1-carboxamide (PubChem CID 55501544) has the molecular formula C26H34N4O4S and a molecular weight of 498.65 g/mol. Its IUPAC name is 4-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N-phenylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N-phenylpiperidine-1-carboxamide
PubChem CID55501544
Molecular FormulaC26H34N4O4S
Molecular Weight498.65 g/mol
Exact Mass498.23
IUPAC Name4-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N-phenylpiperidine-1-carboxamide
SMILESCN(C1CCCCC1)S(=O)(=O)c1ccc(C(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)cc1
InChIInChI=1S/C26H34N4O4S/c1-29(23-10-6-3-7-11-23)35(33,34)24-14-12-20(13-15-24)25(31)27-22-16-18-30(19-17-22)26(32)28-21-8-4-2-5-9-21/h2,4-5,8-9,12-15,22-23H,3,6-7,10-11,16-19H2,1H3,(H,27,31)(H,28,32)
InChIKeyWWQDIXSNXAFILM-UHFFFAOYSA-N
XLogP4.07
TPSA98.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500498.65
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-phenyl-4-[[4-(phenylsulfamoyl)benzoyl]amino]piperidine-1-carboxamide
CID 46537325
4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide
CID 7656046
4-[[4-(butan-2-ylsulfamoyl)benzoyl]amino]-N-phenylpiperidine-1-carboxamide
CID 46700441
(3S)-1-[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]-N-phenylpiperidine-3-carboxamide
CID 27745975
4-(4-benzamidopiperidine-1-carbonyl)-N-phenylpiperidine-1-carboxamide
CID 33308938
N-phenyl-4-[(4-pyrrol-1-ylbenzoyl)amino]piperidine-1-carboxamide
CID 25409335
N-[3-[4-[cyclohexyl(methyl)sulfamoyl]anilino]-3-oxopropyl]benzamide
CID 26906866
N-[1-(cyclohexanecarbonyl)piperidin-4-yl]-4-[methoxy(methyl)sulfamoyl]benzamide
CID 46463867
N-[4-(cyclopentylcarbamoyl)phenyl]pyrrolidine-1-carboxamide
CID 51085603
4-[cyclopentyl(methyl)sulfamoyl]benzoic acid
CID 43213257
4-benzamido-N-(3-methylphenyl)piperidine-1-carboxamide
CID 43814049
4-[cyclopentyl(methyl)sulfamoyl]-N-(4-fluorophenyl)benzamide
CID 7656086

Frequently Asked Questions

What is the IUPAC name of 4-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N-phenylpiperidine-1-carboxamide?
The IUPAC name of 4-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N-phenylpiperidine-1-carboxamide (CID 55501544) is 4-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N-phenylpiperidine-1-carboxamide.
What is the SMILES notation for 4-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N-phenylpiperidine-1-carboxamide?
The canonical SMILES for 4-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N-phenylpiperidine-1-carboxamide is CN(C1CCCCC1)S(=O)(=O)c1ccc(C(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)cc1.
What is the InChIKey of 4-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N-phenylpiperidine-1-carboxamide?
The InChIKey is WWQDIXSNXAFILM-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H34N4O4S/c1-29(23-10-6-3-7-11-23)35(33,34)24-14-12-20(13-15-24)25(31)27-22-16-18-30(19-17-22)26(32)28-21-8-4-2-5-9-21/h2,4-5,8-9,12-15,22-23H,3,6-7,10-11,16-19H2,1H3,(H,27,31)(H,28,32).
What are the key properties of 4-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N-phenylpiperidine-1-carboxamide?
4-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N-phenylpiperidine-1-carboxamide has a molecular weight of 498.65 g/mol, XLogP of 4.07, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[4-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-N-phenylpiperidine-1-carboxamide is sourced from PubChem (CID 55501544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).