1-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide

C16H30N2O — CID 153459282

IUPAC1-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide
SMILESCC(C)C1CCC(NC(=O)C2CCN(C)CC2)CC1
InChIInChI=1S/C16H30N2O/c1-12(2)13-4-6-15(7-5-13)17-16(19)14-8-10-18(3)11-9-14/h12-15H,4-11H2,1-3H3,(H,17,19)
InChIKeyLJUJMTFIWYGANJ-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.66
Rot. Bonds3

About 1-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide

1-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide (PubChem CID 153459282) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 1-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide
PubChem CID153459282
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name1-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide
SMILESCC(C)C1CCC(NC(=O)C2CCN(C)CC2)CC1
InChIInChI=1S/C16H30N2O/c1-12(2)13-4-6-15(7-5-13)17-16(19)14-8-10-18(3)11-9-14/h12-15H,4-11H2,1-3H3,(H,17,19)
InChIKeyLJUJMTFIWYGANJ-UHFFFAOYSA-N
XLogP2.66
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methyl-N-[4-(methylamino)cyclohexyl]piperidine-4-carboxamide
CID 115277550
N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide;hydrochloride
CID 119339836
4-(hydroxymethyl)-N-(1-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 115151158
3-amino-N-(4-propan-2-ylcyclohexyl)cyclopentane-1-carboxamide;hydrochloride
CID 119812000
N-(4-propan-2-ylcyclohexyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119812040
N-(1-propan-2-ylpiperidin-4-yl)cyclopropanecarboxamide
CID 25236585
N,1-dimethylpiperidine-4-carboxamide;ethane
CID 156719814
4-(methylamino)-N-(1-methylpyrrolidin-3-yl)cyclohexane-1-carboxamide
CID 115150628
2-hydroxy-N-(1-methylpiperidin-4-yl)propanamide
CID 115140450
(2S,4S)-2-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide;hydrochloride
CID 120637437
1-[(2R)-2-methylsulfanylpropanoyl]-N-[4-[[(2R)-2-methylsulfanylpropanoyl]amino]cyclohexyl]piperidine-4-carboxamide
CID 95784499
3-amino-N-(1-methylpiperidin-4-yl)cyclohexane-1-carboxamide
CID 62775601

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide?
The IUPAC name of 1-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide (CID 153459282) is 1-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide?
The canonical SMILES for 1-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide is CC(C)C1CCC(NC(=O)C2CCN(C)CC2)CC1.
What is the InChIKey of 1-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide?
The InChIKey is LJUJMTFIWYGANJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-12(2)13-4-6-15(7-5-13)17-16(19)14-8-10-18(3)11-9-14/h12-15H,4-11H2,1-3H3,(H,17,19).
What are the key properties of 1-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide?
1-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide has a molecular weight of 266.43 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(4-propan-2-ylcyclohexyl)piperidine-4-carboxamide is sourced from PubChem (CID 153459282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).