(3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide

C15H29N3O3S — CID 95877591

IUPAC(3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide
SMILESCN(C)S(=O)(=O)N1CCC[C@H](C(=O)NC2(C)CCCCC2)C1
InChIInChI=1S/C15H29N3O3S/c1-15(9-5-4-6-10-15)16-14(19)13-8-7-11-18(12-13)22(20,21)17(2)3/h13H,4-12H2,1-3H3,(H,16,19)/t13-/m0/s1
InChIKeySXVDLVMXDWVJEA-ZDUSSCGKSA-N
MW331.48 g/mol
LogP1.34
Rot. Bonds4

About (3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide

(3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide (PubChem CID 95877591) has the molecular formula C15H29N3O3S and a molecular weight of 331.48 g/mol. Its IUPAC name is (3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide
PubChem CID95877591
Molecular FormulaC15H29N3O3S
Molecular Weight331.48 g/mol
Exact Mass331.19
IUPAC Name(3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide
SMILESCN(C)S(=O)(=O)N1CCC[C@H](C(=O)NC2(C)CCCCC2)C1
InChIInChI=1S/C15H29N3O3S/c1-15(9-5-4-6-10-15)16-14(19)13-8-7-11-18(12-13)22(20,21)17(2)3/h13H,4-12H2,1-3H3,(H,16,19)/t13-/m0/s1
InChIKeySXVDLVMXDWVJEA-ZDUSSCGKSA-N
XLogP1.34
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.48
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-1-(dimethylsulfamoyl)-N-methylpiperidine-3-carboxamide
CID 94012254
(3S)-1-(dimethylsulfamoyl)-N-[(2S)-3-methylbutan-2-yl]piperidine-3-carboxamide
CID 125074634
(3R)-N-cyclopentyl-1-(dimethylsulfamoyl)piperidine-3-carboxamide
CID 92686253
(3R)-1-(dimethylsulfamoyl)-N-(2-methylpropyl)piperidine-3-carboxamide
CID 28567035
(3R)-1-(dimethylsulfamoyl)-N-[(2S)-pentan-2-yl]piperidine-3-carboxamide
CID 28958223
(3R)-1-(dimethylsulfamoyl)-N,N-dimethylpiperidine-3-carboxamide
CID 92684694
(3R)-1-(dimethylsulfamoyl)-N-(2-methoxyethyl)piperidine-3-carboxamide
CID 28955789
1-(dimethylsulfamoyl)-N-phenylpiperidine-3-carboxamide
CID 46770903
1-(dimethylsulfamoyl)-N-(2,4,5-trichlorophenyl)piperidine-3-carboxamide
CID 43905928
(3S)-1-(dimethylsulfamoyl)-N,N-diethylpiperidine-3-carboxamide
CID 92685694
N-(2,6-dimethylphenyl)-1-(dimethylsulfamoyl)piperidine-3-carboxamide
CID 53283870
(3R)-1-(dimethylsulfamoyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-3-carboxamide
CID 93487555

Frequently Asked Questions

What is the IUPAC name of (3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide?
The IUPAC name of (3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide (CID 95877591) is (3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide.
What is the SMILES notation for (3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide?
The canonical SMILES for (3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide is CN(C)S(=O)(=O)N1CCC[C@H](C(=O)NC2(C)CCCCC2)C1.
What is the InChIKey of (3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide?
The InChIKey is SXVDLVMXDWVJEA-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H29N3O3S/c1-15(9-5-4-6-10-15)16-14(19)13-8-7-11-18(12-13)22(20,21)17(2)3/h13H,4-12H2,1-3H3,(H,16,19)/t13-/m0/s1.
What are the key properties of (3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide?
(3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide has a molecular weight of 331.48 g/mol, XLogP of 1.34, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1-(dimethylsulfamoyl)-N-(1-methylcyclohexyl)piperidine-3-carboxamide is sourced from PubChem (CID 95877591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).