3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide

C14H27N3O3S — CID 51083495

IUPAC3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide
SMILESCC1CCC(NC(=O)N2CCCC(NS(C)(=O)=O)C2)CC1
InChIInChI=1S/C14H27N3O3S/c1-11-5-7-12(8-6-11)15-14(18)17-9-3-4-13(10-17)16-21(2,19)20/h11-13,16H,3-10H2,1-2H3,(H,15,18)
InChIKeyXQIRKOWYGMPSNG-UHFFFAOYSA-N
MW317.46 g/mol
LogP1.29
Rot. Bonds3

About 3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide

3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide (PubChem CID 51083495) has the molecular formula C14H27N3O3S and a molecular weight of 317.46 g/mol. Its IUPAC name is 3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide
PubChem CID51083495
Molecular FormulaC14H27N3O3S
Molecular Weight317.46 g/mol
Exact Mass317.18
IUPAC Name3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide
SMILESCC1CCC(NC(=O)N2CCCC(NS(C)(=O)=O)C2)CC1
InChIInChI=1S/C14H27N3O3S/c1-11-5-7-12(8-6-11)15-14(18)17-9-3-4-13(10-17)16-21(2,19)20/h11-13,16H,3-10H2,1-2H3,(H,15,18)
InChIKeyXQIRKOWYGMPSNG-UHFFFAOYSA-N
XLogP1.29
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.46
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-N-[(1S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-yl]-3-(methanesulfonamido)piperidine-1-carboxamide
CID 95126760
3-(hydroxymethyl)-N-(4-methylcyclohexyl)piperidine-1-carboxamide
CID 110894815
N-[1-(2,2,2-trifluoroacetyl)piperidin-3-yl]methanesulfonamide
CID 62490631
N-cyclopropyl-3-(methylsulfonylmethyl)piperidine-1-carboxamide
CID 146083111
(3R)-N-cyclohexyl-3-methylpyrrolidine-1-carboxamide
CID 66581198
N-[(3S)-1-(7-fluorobicyclo[4.1.0]heptane-7-carbonyl)piperidin-3-yl]methanesulfonamide
CID 166310642
N-[1-(4-aminobenzoyl)piperidin-3-yl]methanesulfonamide
CID 60945770
N-[1-(3-methylpyrrolidine-2-carbonyl)piperidin-3-yl]methanesulfonamide
CID 102778694
N-[1-(3,5-dibromobenzoyl)piperidin-3-yl]methanesulfonamide
CID 103907786
N-[1-(3-aminobutanoyl)piperidin-3-yl]methanesulfonamide
CID 54871310
N-[1-(imidazole-1-carbonyl)piperidin-3-yl]methanesulfonamide
CID 113225834
3-(methanesulfonamido)-N-(4-pyrrolidin-1-ylsulfonylphenyl)piperidine-1-carboxamide
CID 47038794

Frequently Asked Questions

What is the IUPAC name of 3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide?
The IUPAC name of 3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide (CID 51083495) is 3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide.
What is the SMILES notation for 3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide?
The canonical SMILES for 3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide is CC1CCC(NC(=O)N2CCCC(NS(C)(=O)=O)C2)CC1.
What is the InChIKey of 3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide?
The InChIKey is XQIRKOWYGMPSNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O3S/c1-11-5-7-12(8-6-11)15-14(18)17-9-3-4-13(10-17)16-21(2,19)20/h11-13,16H,3-10H2,1-2H3,(H,15,18).
What are the key properties of 3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide?
3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide has a molecular weight of 317.46 g/mol, XLogP of 1.29, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methanesulfonamido)-N-(4-methylcyclohexyl)piperidine-1-carboxamide is sourced from PubChem (CID 51083495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).