2-[cyclohexyl(ethyl)amino]-1-(2-methylphenyl)ethanone

C17H25NO — CID 43794251

IUPAC2-[cyclohexyl(ethyl)amino]-1-(2-methylphenyl)ethanone
SMILESCCN(CC(=O)c1ccccc1C)C1CCCCC1
InChIInChI=1S/C17H25NO/c1-3-18(15-10-5-4-6-11-15)13-17(19)16-12-8-7-9-14(16)2/h7-9,12,15H,3-6,10-11,13H2,1-2H3
InChIKeyVJPBCGHJQVEIAH-UHFFFAOYSA-N
MW259.39 g/mol
LogP3.83
Rot. Bonds5

About 2-[cyclohexyl(ethyl)amino]-1-(2-methylphenyl)ethanone

2-[cyclohexyl(ethyl)amino]-1-(2-methylphenyl)ethanone (PubChem CID 43794251) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is 2-[cyclohexyl(ethyl)amino]-1-(2-methylphenyl)ethanone.

Molecular Properties

Compound Name2-[cyclohexyl(ethyl)amino]-1-(2-methylphenyl)ethanone
PubChem CID43794251
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC Name2-[cyclohexyl(ethyl)amino]-1-(2-methylphenyl)ethanone
SMILESCCN(CC(=O)c1ccccc1C)C1CCCCC1
InChIInChI=1S/C17H25NO/c1-3-18(15-10-5-4-6-11-15)13-17(19)16-12-8-7-9-14(16)2/h7-9,12,15H,3-6,10-11,13H2,1-2H3
InChIKeyVJPBCGHJQVEIAH-UHFFFAOYSA-N
XLogP3.83
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 53.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[cyclohexyl(ethyl)amino]-1-(2-ethoxyphenyl)ethanone
CID 43794243
1-[cyclohexyl(ethyl)amino]-3-phenylpropan-2-one
CID 43794247
2-[cyclopropyl(ethyl)amino]-1-(2-methoxyphenyl)ethanone
CID 43794992
1-(2-chlorophenyl)-3-[cyclopentyl(ethyl)amino]propan-1-one
CID 62645176
2-[cyclopentyl(ethyl)amino]-1-(furan-2-yl)ethanone
CID 43796327
N-[3-[cyclohexyl(ethyl)amino]-3-oxopropyl]-2-methylbenzamide
CID 24632581
2-cyclobutyl-1-(2-methylphenyl)ethanone
CID 65460155
2-[cyclopentyl(2-hydroxyethyl)amino]-1-(2-methoxyphenyl)ethanone
CID 62034936
2-[cyclohexyl(ethyl)amino]-1-(3,4-dichlorophenyl)ethanone
CID 43219722
2-[cyclopentyl(ethyl)amino]-1-(4-methylsulfanylphenyl)ethanone
CID 43796358
2-[ethyl(propan-2-yl)amino]-1-(2-methylphenyl)ethanone
CID 43795126
2-(dimethylamino)-1-(2-methylphenyl)ethanone;hydrochloride
CID 178200159

Frequently Asked Questions

What is the IUPAC name of 2-[cyclohexyl(ethyl)amino]-1-(2-methylphenyl)ethanone?
The IUPAC name of 2-[cyclohexyl(ethyl)amino]-1-(2-methylphenyl)ethanone (CID 43794251) is 2-[cyclohexyl(ethyl)amino]-1-(2-methylphenyl)ethanone.
What is the SMILES notation for 2-[cyclohexyl(ethyl)amino]-1-(2-methylphenyl)ethanone?
The canonical SMILES for 2-[cyclohexyl(ethyl)amino]-1-(2-methylphenyl)ethanone is CCN(CC(=O)c1ccccc1C)C1CCCCC1.
What is the InChIKey of 2-[cyclohexyl(ethyl)amino]-1-(2-methylphenyl)ethanone?
The InChIKey is VJPBCGHJQVEIAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-3-18(15-10-5-4-6-11-15)13-17(19)16-12-8-7-9-14(16)2/h7-9,12,15H,3-6,10-11,13H2,1-2H3.
What are the key properties of 2-[cyclohexyl(ethyl)amino]-1-(2-methylphenyl)ethanone?
2-[cyclohexyl(ethyl)amino]-1-(2-methylphenyl)ethanone has a molecular weight of 259.39 g/mol, XLogP of 3.83, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclohexyl(ethyl)amino]-1-(2-methylphenyl)ethanone is sourced from PubChem (CID 43794251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).