(2-ethylpiperidin-1-yl)-(2-methylcyclohexyl)methanone

C15H27NO — CID 3049452

IUPAC(2-ethylpiperidin-1-yl)-(2-methylcyclohexyl)methanone
SMILESCCC1CCCCN1C(=O)C1CCCCC1C
InChIInChI=1S/C15H27NO/c1-3-13-9-6-7-11-16(13)15(17)14-10-5-4-8-12(14)2/h12-14H,3-11H2,1-2H3
InChIKeyOPFKZNFXOYNUSY-UHFFFAOYSA-N
MW237.39 g/mol
LogP3.60
Rot. Bonds2

About (2-ethylpiperidin-1-yl)-(2-methylcyclohexyl)methanone

(2-ethylpiperidin-1-yl)-(2-methylcyclohexyl)methanone (PubChem CID 3049452) has the molecular formula C15H27NO and a molecular weight of 237.39 g/mol. Its IUPAC name is (2-ethylpiperidin-1-yl)-(2-methylcyclohexyl)methanone.

Molecular Properties

Compound Name(2-ethylpiperidin-1-yl)-(2-methylcyclohexyl)methanone
PubChem CID3049452
Molecular FormulaC15H27NO
Molecular Weight237.39 g/mol
Exact Mass237.21
IUPAC Name(2-ethylpiperidin-1-yl)-(2-methylcyclohexyl)methanone
SMILESCCC1CCCCN1C(=O)C1CCCCC1C
InChIInChI=1S/C15H27NO/c1-3-13-9-6-7-11-16(13)15(17)14-10-5-4-8-12(14)2/h12-14H,3-11H2,1-2H3
InChIKeyOPFKZNFXOYNUSY-UHFFFAOYSA-N
XLogP3.60
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Piperidine, 1-(cyclohexylcarbonyl)-2,6-dimethyl-
CID 199799
Pexantel
CID 667497
Cyclohexanecarboxamide, N,N-dipropyl-
CID 152793
Cyclohexyl(2-methylpiperidin-1-yl)methanone
CID 558510
Cyclohexanecarboxamide, N,N-diethyl-
CID 94872
N,N-Diethylcyclohexanepropanamide
CID 95064
Piperidine, 1-(cyclohexylcarbonyl)-3-methyl-
CID 2915080
4-Ethyl-4-azabicyclo[3.3.1]nonan-3-one
CID 269578
1-Cyclohexanecarbonyl-4-ethylpiperazine
CID 798754
1-Cyclohexylcarbonyl-2-ethylpiperidine
CID 2915910
Piperidine, 1-(cyclohexylcarbonyl)-
CID 12760854
Cyclohexanecarboxamide, N,N-dibutyl-
CID 533209

Frequently Asked Questions

What is the IUPAC name of (2-ethylpiperidin-1-yl)-(2-methylcyclohexyl)methanone?
The IUPAC name of (2-ethylpiperidin-1-yl)-(2-methylcyclohexyl)methanone (CID 3049452) is (2-ethylpiperidin-1-yl)-(2-methylcyclohexyl)methanone.
What is the SMILES notation for (2-ethylpiperidin-1-yl)-(2-methylcyclohexyl)methanone?
The canonical SMILES for (2-ethylpiperidin-1-yl)-(2-methylcyclohexyl)methanone is CCC1CCCCN1C(=O)C1CCCCC1C.
What is the InChIKey of (2-ethylpiperidin-1-yl)-(2-methylcyclohexyl)methanone?
The InChIKey is OPFKZNFXOYNUSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27NO/c1-3-13-9-6-7-11-16(13)15(17)14-10-5-4-8-12(14)2/h12-14H,3-11H2,1-2H3.
What are the key properties of (2-ethylpiperidin-1-yl)-(2-methylcyclohexyl)methanone?
(2-ethylpiperidin-1-yl)-(2-methylcyclohexyl)methanone has a molecular weight of 237.39 g/mol, XLogP of 3.60, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylpiperidin-1-yl)-(2-methylcyclohexyl)methanone is sourced from PubChem (CID 3049452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).