N-cyclohexyl-1-methylsulfonylpiperidine-4-carboxamide

C13H24N2O3S — CID 892626

IUPACN-cyclohexyl-1-methylsulfonylpiperidine-4-carboxamide
SMILESCS(=O)(=O)N1CCC(C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C13H24N2O3S/c1-19(17,18)15-9-7-11(8-10-15)13(16)14-12-5-3-2-4-6-12/h11-12H,2-10H2,1H3,(H,14,16)
InChIKeySPNMGYJDXWEWDC-UHFFFAOYSA-N
MW288.41 g/mol
LogP1.11
Rot. Bonds3

About N-cyclohexyl-1-methylsulfonylpiperidine-4-carboxamide

N-cyclohexyl-1-methylsulfonylpiperidine-4-carboxamide (PubChem CID 892626) has the molecular formula C13H24N2O3S and a molecular weight of 288.41 g/mol. Its IUPAC name is N-cyclohexyl-1-methylsulfonylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-1-methylsulfonylpiperidine-4-carboxamide
PubChem CID892626
Molecular FormulaC13H24N2O3S
Molecular Weight288.41 g/mol
Exact Mass288.15
IUPAC NameN-cyclohexyl-1-methylsulfonylpiperidine-4-carboxamide
SMILESCS(=O)(=O)N1CCC(C(=O)NC2CCCCC2)CC1
InChIInChI=1S/C13H24N2O3S/c1-19(17,18)15-9-7-11(8-10-15)13(16)14-12-5-3-2-4-6-12/h11-12H,2-10H2,1H3,(H,14,16)
InChIKeySPNMGYJDXWEWDC-UHFFFAOYSA-N
XLogP1.11
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.41
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclohexyl-1-(ethylsulfonyl)piperidine-4-carboxamide
CID 3236575
N-(2-methylcyclohexyl)-1-(propylsulfonyl)piperidine-4-carboxamide
CID 3238894
1-(azepan-1-ylsulfonyl)-N-cyclohexylpiperidine-4-carboxamide
CID 3243872
N-cycloheptyl-1-(2-methylpropylsulfonyl)piperidine-4-carboxamide
CID 57391642
N-cycloheptyl-1-propan-2-ylsulfonylpiperidine-4-carboxamide
CID 57393386
N-cycloheptyl-1-cyclohexylsulfonylpiperidine-4-carboxamide
CID 57395107
N-(3-methylbutyl)-1-(propylsulfonyl)piperidine-4-carboxamide
CID 4295316
Pentanamide, N-(1-(ethylsulfonyl)-4-piperidinyl)-2-propyl-
CID 1822717
Cyclohexanecarboxylic acid (1-ethanesulfonyl-piperidin-4-yl)-amide
CID 645503
1-[2-(Cyclohexyl-methanesulfonyl-amino)-acetyl]-piperidine-4-carboxylic acid amide
CID 652038
N-cyclohexyl-1-(propylsulfonyl)piperidine-3-carboxamide
CID 3236558
N-(sec-butyl)-1-(ethylsulfonyl)piperidine-4-carboxamide
CID 3237619

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-methylsulfonylpiperidine-4-carboxamide?
The IUPAC name of N-cyclohexyl-1-methylsulfonylpiperidine-4-carboxamide (CID 892626) is N-cyclohexyl-1-methylsulfonylpiperidine-4-carboxamide.
What is the SMILES notation for N-cyclohexyl-1-methylsulfonylpiperidine-4-carboxamide?
The canonical SMILES for N-cyclohexyl-1-methylsulfonylpiperidine-4-carboxamide is CS(=O)(=O)N1CCC(C(=O)NC2CCCCC2)CC1.
What is the InChIKey of N-cyclohexyl-1-methylsulfonylpiperidine-4-carboxamide?
The InChIKey is SPNMGYJDXWEWDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O3S/c1-19(17,18)15-9-7-11(8-10-15)13(16)14-12-5-3-2-4-6-12/h11-12H,2-10H2,1H3,(H,14,16).
What are the key properties of N-cyclohexyl-1-methylsulfonylpiperidine-4-carboxamide?
N-cyclohexyl-1-methylsulfonylpiperidine-4-carboxamide has a molecular weight of 288.41 g/mol, XLogP of 1.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-methylsulfonylpiperidine-4-carboxamide is sourced from PubChem (CID 892626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).