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

C16H30N2O — CID 106740120

IUPAC2-methyl-N-[2-(4-methylcyclohexyl)ethyl]piperidine-4-carboxamide
SMILESCC1CCC(CCNC(=O)C2CCNC(C)C2)CC1
InChIInChI=1S/C16H30N2O/c1-12-3-5-14(6-4-12)7-9-18-16(19)15-8-10-17-13(2)11-15/h12-15,17H,3-11H2,1-2H3,(H,18,19)
InChIKeyPDEFKDBKORYBSZ-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.71
Rot. Bonds4

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

2-methyl-N-[2-(4-methylcyclohexyl)ethyl]piperidine-4-carboxamide (PubChem CID 106740120) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 2-methyl-N-[2-(4-methylcyclohexyl)ethyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name2-methyl-N-[2-(4-methylcyclohexyl)ethyl]piperidine-4-carboxamide
PubChem CID106740120
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name2-methyl-N-[2-(4-methylcyclohexyl)ethyl]piperidine-4-carboxamide
SMILESCC1CCC(CCNC(=O)C2CCNC(C)C2)CC1
InChIInChI=1S/C16H30N2O/c1-12-3-5-14(6-4-12)7-9-18-16(19)15-8-10-17-13(2)11-15/h12-15,17H,3-11H2,1-2H3,(H,18,19)
InChIKeyPDEFKDBKORYBSZ-UHFFFAOYSA-N
XLogP2.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,4S)-N-(2-cyclopropylethyl)-2-methylpiperidine-4-carboxamide
CID 120633867
N-(2-hydroxyethyl)-2-methylpiperidine-4-carboxamide
CID 106738732
(2S,4S)-2-methyl-N-[2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]ethyl]piperidine-4-carboxamide
CID 120638355
(2S,4S)-N-[3-(cyclopropylmethoxy)propyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120618698
2-methyl-N-prop-2-ynylpiperidine-4-carboxamide
CID 106738666
(2S,4S)-N-[2-(azepan-1-yl)ethyl]-2-methylpiperidine-4-carboxamide
CID 120632718
2-hydroxy-4-[(2-methylpiperidine-4-carbonyl)amino]butanoic acid
CID 114006821
(2S,4S)-N-[2-[cyclopropyl(ethyl)amino]ethyl]-2-methylpiperidine-4-carboxamide;hydrochloride
CID 120635209
N-(cyanomethyl)-2-methylpiperidine-4-carboxamide
CID 106739785
(2S,4S)-2-methyl-N-[2-[methyl(propan-2-yl)amino]ethyl]piperidine-4-carboxamide
CID 120635200
ethyl 3-[(2-methylpiperidine-4-carbonyl)amino]propanoate
CID 106739889
N-[2-(4-methylcyclohexyl)ethyl]thiomorpholine-3-carboxamide
CID 82917563

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(4-methylcyclohexyl)ethyl]piperidine-4-carboxamide?
The IUPAC name of 2-methyl-N-[2-(4-methylcyclohexyl)ethyl]piperidine-4-carboxamide (CID 106740120) is 2-methyl-N-[2-(4-methylcyclohexyl)ethyl]piperidine-4-carboxamide.
What is the SMILES notation for 2-methyl-N-[2-(4-methylcyclohexyl)ethyl]piperidine-4-carboxamide?
The canonical SMILES for 2-methyl-N-[2-(4-methylcyclohexyl)ethyl]piperidine-4-carboxamide is CC1CCC(CCNC(=O)C2CCNC(C)C2)CC1.
What is the InChIKey of 2-methyl-N-[2-(4-methylcyclohexyl)ethyl]piperidine-4-carboxamide?
The InChIKey is PDEFKDBKORYBSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-12-3-5-14(6-4-12)7-9-18-16(19)15-8-10-17-13(2)11-15/h12-15,17H,3-11H2,1-2H3,(H,18,19).
What are the key properties of 2-methyl-N-[2-(4-methylcyclohexyl)ethyl]piperidine-4-carboxamide?
2-methyl-N-[2-(4-methylcyclohexyl)ethyl]piperidine-4-carboxamide has a molecular weight of 266.43 g/mol, XLogP of 2.71, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(4-methylcyclohexyl)ethyl]piperidine-4-carboxamide is sourced from PubChem (CID 106740120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).