4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide

C17H32N2O — CID 63121777

IUPAC4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide
SMILESCC1CCC(C(C)C)C(NC(=O)C2(C)CCNCC2)C1
InChIInChI=1S/C17H32N2O/c1-12(2)14-6-5-13(3)11-15(14)19-16(20)17(4)7-9-18-10-8-17/h12-15,18H,5-11H2,1-4H3,(H,19,20)
InChIKeyXKEVCFXUQPLPNZ-UHFFFAOYSA-N
MW280.46 g/mol
LogP2.95
Rot. Bonds3

About 4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide

4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide (PubChem CID 63121777) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide
PubChem CID63121777
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide
SMILESCC1CCC(C(C)C)C(NC(=O)C2(C)CCNCC2)C1
InChIInChI=1S/C17H32N2O/c1-12(2)14-6-5-13(3)11-15(14)19-16(20)17(4)7-9-18-10-8-17/h12-15,18H,5-11H2,1-4H3,(H,19,20)
InChIKeyXKEVCFXUQPLPNZ-UHFFFAOYSA-N
XLogP2.95
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide?
The IUPAC name of 4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide (CID 63121777) is 4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide.
What is the SMILES notation for 4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide?
The canonical SMILES for 4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide is CC1CCC(C(C)C)C(NC(=O)C2(C)CCNCC2)C1.
What is the InChIKey of 4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide?
The InChIKey is XKEVCFXUQPLPNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-12(2)14-6-5-13(3)11-15(14)19-16(20)17(4)7-9-18-10-8-17/h12-15,18H,5-11H2,1-4H3,(H,19,20).
What are the key properties of 4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide?
4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide has a molecular weight of 280.46 g/mol, XLogP of 2.95, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(5-methyl-2-propan-2-ylcyclohexyl)piperidine-4-carboxamide is sourced from PubChem (CID 63121777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).