2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one

C15H23NO2 — CID 82952096

IUPAC2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one
SMILESCOCCN(C(C)C)C(C)C(=O)c1ccccc1
InChIInChI=1S/C15H23NO2/c1-12(2)16(10-11-18-4)13(3)15(17)14-8-6-5-7-9-14/h5-9,12-13H,10-11H2,1-4H3
InChIKeyFQXBNNUGDXJSQQ-UHFFFAOYSA-N
MW249.35 g/mol
LogP2.61
Rot. Bonds7

About 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one

2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one (PubChem CID 82952096) has the molecular formula C15H23NO2 and a molecular weight of 249.35 g/mol. Its IUPAC name is 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one.

Molecular Properties

Compound Name2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one
PubChem CID82952096
Molecular FormulaC15H23NO2
Molecular Weight249.35 g/mol
Exact Mass249.17
IUPAC Name2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one
SMILESCOCCN(C(C)C)C(C)C(=O)c1ccccc1
InChIInChI=1S/C15H23NO2/c1-12(2)16(10-11-18-4)13(3)15(17)14-8-6-5-7-9-14/h5-9,12-13H,10-11H2,1-4H3
InChIKeyFQXBNNUGDXJSQQ-UHFFFAOYSA-N
XLogP2.61
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.35
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-phenyl-2-[propan-2-yl(propyl)amino]propan-1-one
CID 43795382
2-[(1-oxo-1-phenylpropan-2-yl)-propan-2-ylamino]acetamide
CID 60680052
1-(2,4-difluorophenyl)-2-[2-methoxyethyl(propan-2-yl)amino]propan-1-one
CID 82951646
2-[ethyl(methyl)amino]-1-phenylpropan-1-one
CID 43794825
N-(2-cyanophenyl)-2-[2-methoxyethyl(propan-2-yl)amino]propanamide
CID 82938584
2-[2-methoxyethyl(methyl)amino]-1-(4-methylphenyl)propan-1-one
CID 61427109
2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-ol
CID 82960332
N-[2-(aminomethyl)phenyl]-2-[2-methoxyethyl(propan-2-yl)amino]propanamide
CID 82941643
2-[2-methoxyethyl(methyl)amino]-1-(4-methoxyphenyl)propan-1-one
CID 61427604
4-methoxy-2,3-dimethyl-1-phenylbutan-1-one
CID 104845056
3-[2-methoxyethyl(phenacyl)amino]-2-methylpropanoic acid
CID 82329885
2,3-dimethoxy-1-phenylpropan-1-one
CID 90073170

Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one?
The IUPAC name of 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one (CID 82952096) is 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one.
What is the SMILES notation for 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one?
The canonical SMILES for 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one is COCCN(C(C)C)C(C)C(=O)c1ccccc1.
What is the InChIKey of 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one?
The InChIKey is FQXBNNUGDXJSQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2/c1-12(2)16(10-11-18-4)13(3)15(17)14-8-6-5-7-9-14/h5-9,12-13H,10-11H2,1-4H3.
What are the key properties of 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one?
2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one has a molecular weight of 249.35 g/mol, XLogP of 2.61, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxyethyl(propan-2-yl)amino]-1-phenylpropan-1-one is sourced from PubChem (CID 82952096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).