3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide

C16H30N2O — CID 115629689

IUPAC3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide
SMILESCC1CCCC(CCNC(=O)N2CCCC(C)C2)C1
InChIInChI=1S/C16H30N2O/c1-13-5-3-7-15(11-13)8-9-17-16(19)18-10-4-6-14(2)12-18/h13-15H,3-12H2,1-2H3,(H,17,19)
InChIKeyCOVRXNSJMLHZTR-UHFFFAOYSA-N
MW266.43 g/mol
LogP3.64
Rot. Bonds3

About 3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide

3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide (PubChem CID 115629689) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide.

Molecular Properties

Compound Name3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide
PubChem CID115629689
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide
SMILESCC1CCCC(CCNC(=O)N2CCCC(C)C2)C1
InChIInChI=1S/C16H30N2O/c1-13-5-3-7-15(11-13)8-9-17-16(19)18-10-4-6-14(2)12-18/h13-15H,3-12H2,1-2H3,(H,17,19)
InChIKeyCOVRXNSJMLHZTR-UHFFFAOYSA-N
XLogP3.64
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-cyclopentylethyl)-3,5-dimethylpiperidine-1-carboxamide
CID 55808732
N-[(3-hydroxycyclohexyl)methyl]-3-methylpiperidine-1-carboxamide
CID 106124949
N-ethyl-3-methylpiperidine-1-carboxamide
CID 89048200
N-(4-amino-4-oxobutyl)-3-methylpiperidine-1-carboxamide
CID 115584144
N-(2-cyclohexylethyl)-3-hydroxypiperidine-1-carboxamide
CID 110896376
N-(2-cyclopentylethyl)-2-methylmorpholine-4-carboxamide
CID 78892468
(3S)-1-(2-cyclopentylethylcarbamoyl)piperidine-3-carboxylic acid
CID 81125798
3-(hydroxymethyl)-N-[(3-methylcyclohexyl)methyl]pyrrolidine-1-carboxamide
CID 111443830
2-hydroxy-2-methyl-N-[2-(3-methylcyclohexyl)ethyl]propanamide
CID 103430075
3-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]piperidine-1-carboxamide
CID 116654402
(2R)-2-amino-N-[2-(3-methylcyclohexyl)ethyl]propanamide
CID 78966012
N-[2-[cyclopropyl(methyl)amino]ethyl]-3-methylpiperidine-1-carboxamide
CID 115623615

Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide?
The IUPAC name of 3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide (CID 115629689) is 3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide.
What is the SMILES notation for 3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide?
The canonical SMILES for 3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide is CC1CCCC(CCNC(=O)N2CCCC(C)C2)C1.
What is the InChIKey of 3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide?
The InChIKey is COVRXNSJMLHZTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-13-5-3-7-15(11-13)8-9-17-16(19)18-10-4-6-14(2)12-18/h13-15H,3-12H2,1-2H3,(H,17,19).
What are the key properties of 3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide?
3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide has a molecular weight of 266.43 g/mol, XLogP of 3.64, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-[2-(3-methylcyclohexyl)ethyl]piperidine-1-carboxamide is sourced from PubChem (CID 115629689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).