N-(2,3-dimethylcyclohexyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide

C19H35N3O3S — CID 3690131

IUPACN-(2,3-dimethylcyclohexyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide
SMILESCC1CCCC(NC(=O)C2CCN(S(=O)(=O)N3CCCCC3)CC2)C1C
InChIInChI=1S/C19H35N3O3S/c1-15-7-6-8-18(16(15)2)20-19(23)17-9-13-22(14-10-17)26(24,25)21-11-4-3-5-12-21/h15-18H,3-14H2,1-2H3,(H,20,23)
InChIKeyFUGVBRYQGMKFNW-UHFFFAOYSA-N
MW385.57 g/mol
LogP2.37
Rot. Bonds4

About N-(2,3-dimethylcyclohexyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide

N-(2,3-dimethylcyclohexyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide (PubChem CID 3690131) has the molecular formula C19H35N3O3S and a molecular weight of 385.57 g/mol. Its IUPAC name is N-(2,3-dimethylcyclohexyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2,3-dimethylcyclohexyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide
PubChem CID3690131
Molecular FormulaC19H35N3O3S
Molecular Weight385.57 g/mol
Exact Mass385.24
IUPAC NameN-(2,3-dimethylcyclohexyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide
SMILESCC1CCCC(NC(=O)C2CCN(S(=O)(=O)N3CCCCC3)CC2)C1C
InChIInChI=1S/C19H35N3O3S/c1-15-7-6-8-18(16(15)2)20-19(23)17-9-13-22(14-10-17)26(24,25)21-11-4-3-5-12-21/h15-18H,3-14H2,1-2H3,(H,20,23)
InChIKeyFUGVBRYQGMKFNW-UHFFFAOYSA-N
XLogP2.37
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.57
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dimethylcyclohexyl)-1-(propylsulfonyl)piperidine-4-carboxamide
CID 3238260
1-(azepan-1-ylsulfonyl)-N-(2-methylcyclohexyl)piperidine-4-carboxamide
CID 3242481
N-(2,3-dimethylcyclohexyl)-1-(morpholin-4-ylsulfonyl)piperidine-4-carboxamide
CID 3241130
1-(azepan-1-ylsulfonyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide
CID 4228659
1-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-(2-methylcyclohexyl)piperidine-3-carboxamide
CID 4070416
1-[bis(2-methylpropyl)sulfamoyl]-N-(2-methylcyclohexyl)piperidine-4-carboxamide
CID 3331250
N-(2,3-dimethylcyclohexyl)-1-(3,5-dimethylpiperidin-1-yl)sulfonylpiperidine-3-carboxamide
CID 3415096
N-(2-methylcyclohexyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide
CID 3515692
N-(2,3-dimethylcyclohexyl)-1-ethylsulfonylpiperidine-4-carboxamide
CID 3625500
N-(2,3-dimethylcyclohexyl)-1-(4-methylpiperidin-1-yl)sulfonylpiperidine-4-carboxamide
CID 3688971
N-(2,3-dimethylcyclohexyl)-1-pyrrolidin-1-ylsulfonylpiperidine-4-carboxamide
CID 4097587
1-(diethylsulfamoyl)-N-(2,3-dimethylcyclohexyl)piperidine-4-carboxamide
CID 4134017

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylcyclohexyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide?
The IUPAC name of N-(2,3-dimethylcyclohexyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide (CID 3690131) is N-(2,3-dimethylcyclohexyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide.
What is the SMILES notation for N-(2,3-dimethylcyclohexyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide?
The canonical SMILES for N-(2,3-dimethylcyclohexyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide is CC1CCCC(NC(=O)C2CCN(S(=O)(=O)N3CCCCC3)CC2)C1C.
What is the InChIKey of N-(2,3-dimethylcyclohexyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide?
The InChIKey is FUGVBRYQGMKFNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H35N3O3S/c1-15-7-6-8-18(16(15)2)20-19(23)17-9-13-22(14-10-17)26(24,25)21-11-4-3-5-12-21/h15-18H,3-14H2,1-2H3,(H,20,23).
What are the key properties of N-(2,3-dimethylcyclohexyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide?
N-(2,3-dimethylcyclohexyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide has a molecular weight of 385.57 g/mol, XLogP of 2.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylcyclohexyl)-1-piperidin-1-ylsulfonylpiperidine-4-carboxamide is sourced from PubChem (CID 3690131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).