4-methoxy-N-[(2-methylcyclohexyl)methyl]piperidine-4-carboxamide

C15H28N2O2 — CID 119750242

IUPAC4-methoxy-N-[(2-methylcyclohexyl)methyl]piperidine-4-carboxamide
SMILESCOC1(C(=O)NCC2CCCCC2C)CCNCC1
InChIInChI=1S/C15H28N2O2/c1-12-5-3-4-6-13(12)11-17-14(18)15(19-2)7-9-16-10-8-15/h12-13,16H,3-11H2,1-2H3,(H,17,18)
InChIKeyDOUMTXLWWNJOKD-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.70
Rot. Bonds4

About 4-methoxy-N-[(2-methylcyclohexyl)methyl]piperidine-4-carboxamide

4-methoxy-N-[(2-methylcyclohexyl)methyl]piperidine-4-carboxamide (PubChem CID 119750242) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 4-methoxy-N-[(2-methylcyclohexyl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-[(2-methylcyclohexyl)methyl]piperidine-4-carboxamide
PubChem CID119750242
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name4-methoxy-N-[(2-methylcyclohexyl)methyl]piperidine-4-carboxamide
SMILESCOC1(C(=O)NCC2CCCCC2C)CCNCC1
InChIInChI=1S/C15H28N2O2/c1-12-5-3-4-6-13(12)11-17-14(18)15(19-2)7-9-16-10-8-15/h12-13,16H,3-11H2,1-2H3,(H,17,18)
InChIKeyDOUMTXLWWNJOKD-UHFFFAOYSA-N
XLogP1.70
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(2-methylcyclohexyl)methyl]piperidine-4-carboxamide?
The IUPAC name of 4-methoxy-N-[(2-methylcyclohexyl)methyl]piperidine-4-carboxamide (CID 119750242) is 4-methoxy-N-[(2-methylcyclohexyl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for 4-methoxy-N-[(2-methylcyclohexyl)methyl]piperidine-4-carboxamide?
The canonical SMILES for 4-methoxy-N-[(2-methylcyclohexyl)methyl]piperidine-4-carboxamide is COC1(C(=O)NCC2CCCCC2C)CCNCC1.
What is the InChIKey of 4-methoxy-N-[(2-methylcyclohexyl)methyl]piperidine-4-carboxamide?
The InChIKey is DOUMTXLWWNJOKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-12-5-3-4-6-13(12)11-17-14(18)15(19-2)7-9-16-10-8-15/h12-13,16H,3-11H2,1-2H3,(H,17,18).
What are the key properties of 4-methoxy-N-[(2-methylcyclohexyl)methyl]piperidine-4-carboxamide?
4-methoxy-N-[(2-methylcyclohexyl)methyl]piperidine-4-carboxamide has a molecular weight of 268.40 g/mol, XLogP of 1.70, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(2-methylcyclohexyl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 119750242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).