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

C15H28N2O — CID 55116507

IUPAC(5-amino-2-methylcyclohexyl)-(2-ethylpiperidin-1-yl)methanone
SMILESCCC1CCCCN1C(=O)C1CC(N)CCC1C
InChIInChI=1S/C15H28N2O/c1-3-13-6-4-5-9-17(13)15(18)14-10-12(16)8-7-11(14)2/h11-14H,3-10,16H2,1-2H3
InChIKeyOVIWPPWJSOOTHZ-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.54
Rot. Bonds2

About (5-amino-2-methylcyclohexyl)-(2-ethylpiperidin-1-yl)methanone

(5-amino-2-methylcyclohexyl)-(2-ethylpiperidin-1-yl)methanone (PubChem CID 55116507) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is (5-amino-2-methylcyclohexyl)-(2-ethylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(5-amino-2-methylcyclohexyl)-(2-ethylpiperidin-1-yl)methanone
PubChem CID55116507
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name(5-amino-2-methylcyclohexyl)-(2-ethylpiperidin-1-yl)methanone
SMILESCCC1CCCCN1C(=O)C1CC(N)CCC1C
InChIInChI=1S/C15H28N2O/c1-3-13-6-4-5-9-17(13)15(18)14-10-12(16)8-7-11(14)2/h11-14H,3-10,16H2,1-2H3
InChIKeyOVIWPPWJSOOTHZ-UHFFFAOYSA-N
XLogP2.54
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-ethylpyrrolidin-1-yl)-[(1S,2S)-2-methylcyclopropyl]methanone
CID 130685547
2-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 43213005
[2-(2-ethylpiperidine-1-carbonyl)cyclopropyl]-(4-methylpiperidin-1-yl)methanone
CID 109132625
cyclohexyl-[(2R)-2-ethylpiperidin-1-yl]methanone
CID 798108
7-azabicyclo[2.2.1]heptan-2-yl-(2-ethylazepan-1-yl)methanone
CID 112701878
[(2R)-2-ethylpiperidin-1-yl]-[(1S,2R)-2-phenylcyclopropyl]methanone
CID 124714524
4-ethyl-2-[2-(hydroxymethyl)piperidine-1-carbonyl]cyclopentane-1-carboxylic acid
CID 114511445
2-bicyclo[2.2.1]hept-5-enyl-(2-ethylpiperidin-1-yl)methanone
CID 12760884
[4-(aminomethyl)cyclohexyl]-(2-ethylpyrrolidin-1-yl)methanone
CID 62806035
(2-ethylpiperidin-1-yl)-[2-(4-fluorophenyl)cyclopropyl]methanone
CID 134055510
4-(2-ethylpiperidine-1-carbonyl)cyclohexane-1-carboxylic acid
CID 63783975
1-(5-amino-2-methylcyclohexanecarbonyl)piperidine-4-carboxamide
CID 62777378

Frequently Asked Questions

What is the IUPAC name of (5-amino-2-methylcyclohexyl)-(2-ethylpiperidin-1-yl)methanone?
The IUPAC name of (5-amino-2-methylcyclohexyl)-(2-ethylpiperidin-1-yl)methanone (CID 55116507) is (5-amino-2-methylcyclohexyl)-(2-ethylpiperidin-1-yl)methanone.
What is the SMILES notation for (5-amino-2-methylcyclohexyl)-(2-ethylpiperidin-1-yl)methanone?
The canonical SMILES for (5-amino-2-methylcyclohexyl)-(2-ethylpiperidin-1-yl)methanone is CCC1CCCCN1C(=O)C1CC(N)CCC1C.
What is the InChIKey of (5-amino-2-methylcyclohexyl)-(2-ethylpiperidin-1-yl)methanone?
The InChIKey is OVIWPPWJSOOTHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-3-13-6-4-5-9-17(13)15(18)14-10-12(16)8-7-11(14)2/h11-14H,3-10,16H2,1-2H3.
What are the key properties of (5-amino-2-methylcyclohexyl)-(2-ethylpiperidin-1-yl)methanone?
(5-amino-2-methylcyclohexyl)-(2-ethylpiperidin-1-yl)methanone has a molecular weight of 252.40 g/mol, XLogP of 2.54, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5-amino-2-methylcyclohexyl)-(2-ethylpiperidin-1-yl)methanone is sourced from PubChem (CID 55116507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).