1-(benzenesulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide

C19H28N2O3S — CID 134025371

IUPAC1-(benzenesulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide
SMILESCN(C(=O)C1CCCN(S(=O)(=O)c2ccccc2)C1)C1CCCCC1
InChIInChI=1S/C19H28N2O3S/c1-20(17-10-4-2-5-11-17)19(22)16-9-8-14-21(15-16)25(23,24)18-12-6-3-7-13-18/h3,6-7,12-13,16-17H,2,4-5,8-11,14-15H2,1H3
InChIKeyVCWXUDWRCUKYKP-UHFFFAOYSA-N
MW364.51 g/mol
LogP2.88
Rot. Bonds4

About 1-(benzenesulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide

1-(benzenesulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide (PubChem CID 134025371) has the molecular formula C19H28N2O3S and a molecular weight of 364.51 g/mol. Its IUPAC name is 1-(benzenesulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide.

Molecular Properties

Compound Name1-(benzenesulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide
PubChem CID134025371
Molecular FormulaC19H28N2O3S
Molecular Weight364.51 g/mol
Exact Mass364.18
IUPAC Name1-(benzenesulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide
SMILESCN(C(=O)C1CCCN(S(=O)(=O)c2ccccc2)C1)C1CCCCC1
InChIInChI=1S/C19H28N2O3S/c1-20(17-10-4-2-5-11-17)19(22)16-9-8-14-21(15-16)25(23,24)18-12-6-3-7-13-18/h3,6-7,12-13,16-17H,2,4-5,8-11,14-15H2,1H3
InChIKeyVCWXUDWRCUKYKP-UHFFFAOYSA-N
XLogP2.88
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.51
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3S)-1-(4-chlorophenyl)sulfonyl-N-cyclohexyl-N-methylpiperidine-3-carboxamide
CID 51617060
(3S)-N-cyclohexyl-N-methyl-1-[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylpiperidine-3-carboxamide
CID 41024792
1-(4-fluorophenyl)sulfonyl-N-methyl-N-piperidin-4-ylpiperidine-3-carboxamide
CID 119441227
(3R)-N-cyclopentyl-N-methyl-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide
CID 92680091
1-(benzenesulfonyl)-N-benzyl-N-cyclopropylpiperidine-3-carboxamide
CID 46438624
1-(benzenesulfonyl)-N-cyclopropyl-N-prop-2-ynylpiperidine-3-carboxamide
CID 126804241
(3S)-1-(benzenesulfonyl)-N-cycloheptylpiperidine-3-carboxamide
CID 39898448
(3S)-1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide
CID 40961682
N-cycloheptyl-N-methyl-1-(2-phenylacetyl)piperidine-3-carboxamide
CID 55607775
1-(benzenesulfonyl)-N-propan-2-ylpiperidine-3-carboxamide
CID 51179844
(3S)-N,N-dimethyl-1-(4-methylphenyl)sulfonylpiperidine-3-carboxamide
CID 30156240
1-(4-chlorophenyl)sulfonyl-N-cyclohexyl-N-methylpiperidine-4-carboxamide
CID 27670607

Frequently Asked Questions

What is the IUPAC name of 1-(benzenesulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide?
The IUPAC name of 1-(benzenesulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide (CID 134025371) is 1-(benzenesulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide.
What is the SMILES notation for 1-(benzenesulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide?
The canonical SMILES for 1-(benzenesulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide is CN(C(=O)C1CCCN(S(=O)(=O)c2ccccc2)C1)C1CCCCC1.
What is the InChIKey of 1-(benzenesulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide?
The InChIKey is VCWXUDWRCUKYKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O3S/c1-20(17-10-4-2-5-11-17)19(22)16-9-8-14-21(15-16)25(23,24)18-12-6-3-7-13-18/h3,6-7,12-13,16-17H,2,4-5,8-11,14-15H2,1H3.
What are the key properties of 1-(benzenesulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide?
1-(benzenesulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide has a molecular weight of 364.51 g/mol, XLogP of 2.88, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(benzenesulfonyl)-N-cyclohexyl-N-methylpiperidine-3-carboxamide is sourced from PubChem (CID 134025371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).