2-(ethylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone

C15H23NO2 — CID 94978289

IUPAC2-(ethylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone
SMILESCCNCC(=O)c1cc(C(C)C)c(OC)cc1C
InChIInChI=1S/C15H23NO2/c1-6-16-9-14(17)13-8-12(10(2)3)15(18-5)7-11(13)4/h7-8,10,16H,6,9H2,1-5H3
InChIKeyIYKBGIGEQUWFGH-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.92
Rot. Bonds6

About 2-(ethylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone

2-(ethylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone (PubChem CID 94978289) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-(ethylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone.

Molecular Properties

Compound Name2-(ethylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone
PubChem CID94978289
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-(ethylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone
SMILESCCNCC(=O)c1cc(C(C)C)c(OC)cc1C
InChIInChI=1S/C15H23NO2/c1-6-16-9-14(17)13-8-12(10(2)3)15(18-5)7-11(13)4/h7-8,10,16H,6,9H2,1-5H3
InChIKeyIYKBGIGEQUWFGH-UHFFFAOYSA-N
XLogP2.92
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cyclopropylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone
CID 94978847
3-chloro-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)propan-1-one
CID 94978468
1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-3-methylbutan-1-one
CID 94978273
1-(5-tert-butyl-4-methoxy-2-methylphenyl)-2-(ethylamino)ethanone
CID 94978957
4-methoxy-N',2-dimethyl-5-propan-2-ylbenzohydrazide
CID 116846868
ethyl 2-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-2-oxoacetate
CID 95470469
4-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-4-oxobutanenitrile
CID 94977910
4-methoxy-2-methyl-N-(2-methylpropyl)-5-propan-2-ylbenzamide
CID 83405819
3-chloro-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)propane-1,2-dione
CID 116822637
4-methoxy-2-methyl-N-[(2R)-3-methylbutan-2-yl]-5-propan-2-ylbenzamide
CID 100573271
N-(3,5-dichlorophenyl)-4-methoxy-2-methyl-5-propan-2-ylbenzamide
CID 100712843
N-(2-acetamidoethyl)-4-methoxy-2-methyl-5-propan-2-ylbenzamide
CID 110761820

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone?
The IUPAC name of 2-(ethylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone (CID 94978289) is 2-(ethylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone.
What is the SMILES notation for 2-(ethylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone?
The canonical SMILES for 2-(ethylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone is CCNCC(=O)c1cc(C(C)C)c(OC)cc1C.
What is the InChIKey of 2-(ethylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone?
The InChIKey is IYKBGIGEQUWFGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-6-16-9-14(17)13-8-12(10(2)3)15(18-5)7-11(13)4/h7-8,10,16H,6,9H2,1-5H3.
What are the key properties of 2-(ethylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone?
2-(ethylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone has a molecular weight of 249.35 g/mol, XLogP of 2.92, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone is sourced from PubChem (CID 94978289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).