1-(4-methoxyphenyl)-2-(1-methoxypropan-2-ylamino)-2-methylpropan-1-one

C15H23NO3 — CID 19866805

IUPAC1-(4-methoxyphenyl)-2-(1-methoxypropan-2-ylamino)-2-methylpropan-1-one
SMILESCOCC(C)NC(C)(C)C(=O)c1ccc(OC)cc1
InChIInChI=1S/C15H23NO3/c1-11(10-18-4)16-15(2,3)14(17)12-6-8-13(19-5)9-7-12/h6-9,11,16H,10H2,1-5H3
InChIKeyQYDOCVOQXOQQKT-UHFFFAOYSA-N
MW265.35 g/mol
LogP2.28
Rot. Bonds7

About 1-(4-methoxyphenyl)-2-(1-methoxypropan-2-ylamino)-2-methylpropan-1-one

1-(4-methoxyphenyl)-2-(1-methoxypropan-2-ylamino)-2-methylpropan-1-one (PubChem CID 19866805) has the molecular formula C15H23NO3 and a molecular weight of 265.35 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-2-(1-methoxypropan-2-ylamino)-2-methylpropan-1-one.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-2-(1-methoxypropan-2-ylamino)-2-methylpropan-1-one
PubChem CID19866805
Molecular FormulaC15H23NO3
Molecular Weight265.35 g/mol
Exact Mass265.17
IUPAC Name1-(4-methoxyphenyl)-2-(1-methoxypropan-2-ylamino)-2-methylpropan-1-one
SMILESCOCC(C)NC(C)(C)C(=O)c1ccc(OC)cc1
InChIInChI=1S/C15H23NO3/c1-11(10-18-4)16-15(2,3)14(17)12-6-8-13(19-5)9-7-12/h6-9,11,16H,10H2,1-5H3
InChIKeyQYDOCVOQXOQQKT-UHFFFAOYSA-N
XLogP2.28
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-methoxyphenyl)-2-methyl-2-(methylamino)propan-1-one
CID 19866956
2-(2,2-diethoxyethylamino)-1-(4-methoxyphenyl)-2-methylpropan-1-one
CID 97356076
2,2-difluoro-1-(4-methoxyphenyl)ethanone
CID 11593558
2-(tert-butylamino)-3,3,3-trifluoro-1-(4-methoxyphenyl)propan-1-one
CID 162535953
4-methoxybenzoic acid;hydrobromide
CID 172731707
4-methoxybenzoic acid;silver
CID 140722019
1-(4-methoxyphenyl)-2-methylsulfinylpropan-1-one
CID 64640564
1-N,4-N-bis[(2R)-1-methoxypropan-2-yl]benzene-1,4-dicarboxamide
CID 25476067
methyl 2-bromo-2-(methoxymethyl)-3-(4-methoxyphenyl)-3-oxopropanoate
CID 102279905
1-(4-methoxyphenyl)-2-(3-methoxypropylamino)propan-1-one
CID 82100724
2,2,2-triiodo-1-(4-methoxyphenyl)ethanone
CID 86080929
[1-(4-methoxyphenyl)-1-oxopropan-2-yl] 3-(4-fluorophenyl)sulfanylpropanoate
CID 55312601

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-2-(1-methoxypropan-2-ylamino)-2-methylpropan-1-one?
The IUPAC name of 1-(4-methoxyphenyl)-2-(1-methoxypropan-2-ylamino)-2-methylpropan-1-one (CID 19866805) is 1-(4-methoxyphenyl)-2-(1-methoxypropan-2-ylamino)-2-methylpropan-1-one.
What is the SMILES notation for 1-(4-methoxyphenyl)-2-(1-methoxypropan-2-ylamino)-2-methylpropan-1-one?
The canonical SMILES for 1-(4-methoxyphenyl)-2-(1-methoxypropan-2-ylamino)-2-methylpropan-1-one is COCC(C)NC(C)(C)C(=O)c1ccc(OC)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-2-(1-methoxypropan-2-ylamino)-2-methylpropan-1-one?
The InChIKey is QYDOCVOQXOQQKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO3/c1-11(10-18-4)16-15(2,3)14(17)12-6-8-13(19-5)9-7-12/h6-9,11,16H,10H2,1-5H3.
What are the key properties of 1-(4-methoxyphenyl)-2-(1-methoxypropan-2-ylamino)-2-methylpropan-1-one?
1-(4-methoxyphenyl)-2-(1-methoxypropan-2-ylamino)-2-methylpropan-1-one has a molecular weight of 265.35 g/mol, XLogP of 2.28, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-2-(1-methoxypropan-2-ylamino)-2-methylpropan-1-one is sourced from PubChem (CID 19866805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).