3-methoxy-1,1-diphenylpropan-2-one

C16H16O2 — CID 19419205

IUPAC3-methoxy-1,1-diphenylpropan-2-one
SMILESCOCC(=O)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H16O2/c1-18-12-15(17)16(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,16H,12H2,1H3
InChIKeyPFGMQJUOBMSCRX-UHFFFAOYSA-N
MW240.30 g/mol
LogP3.03
Rot. Bonds5

About 3-methoxy-1,1-diphenylpropan-2-one

3-methoxy-1,1-diphenylpropan-2-one (PubChem CID 19419205) has the molecular formula C16H16O2 and a molecular weight of 240.30 g/mol. Its IUPAC name is 3-methoxy-1,1-diphenylpropan-2-one.

Molecular Properties

Compound Name3-methoxy-1,1-diphenylpropan-2-one
PubChem CID19419205
Molecular FormulaC16H16O2
Molecular Weight240.30 g/mol
Exact Mass240.12
IUPAC Name3-methoxy-1,1-diphenylpropan-2-one
SMILESCOCC(=O)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C16H16O2/c1-18-12-15(17)16(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,16H,12H2,1H3
InChIKeyPFGMQJUOBMSCRX-UHFFFAOYSA-N
XLogP3.03
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(1R)-1-amino-3-methoxy-1-phenylpropan-2-one
CID 104891033
5-methoxy-1,1-diphenylpentan-2-one
CID 115601489
1,1,5,5-tetraphenylpentane-2,4-dione
CID 22951899
2-[(2-methoxyacetyl)amino]-2-phenylacetic acid
CID 16776085
(2R)-2-methyl-4-oxo-5,5-diphenylpentanamide
CID 162242633
2-methoxy-N-[(1S)-1-phenylethyl]acetamide
CID 835320
(4R)-4-methyl-1,1-diphenylhexane-2,5-dione
CID 159281542
(E)-4-[3-(4-methylphenyl)-2-oxo-3-phenylpropoxy]-4-oxobut-2-enoic acid
CID 159795832
N-(2-hydroxy-2-phenylethyl)-2-methoxyacetamide
CID 60654245
(2,2-diphenylacetyl)oxymethyl 2,2-diphenylacetate
CID 15332487
4-hydroxy-1,1-dimethoxy-4-phenylbutan-2-one
CID 101201301
2-methylprop-2-enyl 2,2-diphenylacetate
CID 135086240

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1,1-diphenylpropan-2-one?
The IUPAC name of 3-methoxy-1,1-diphenylpropan-2-one (CID 19419205) is 3-methoxy-1,1-diphenylpropan-2-one.
What is the SMILES notation for 3-methoxy-1,1-diphenylpropan-2-one?
The canonical SMILES for 3-methoxy-1,1-diphenylpropan-2-one is COCC(=O)C(c1ccccc1)c1ccccc1.
What is the InChIKey of 3-methoxy-1,1-diphenylpropan-2-one?
The InChIKey is PFGMQJUOBMSCRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O2/c1-18-12-15(17)16(13-8-4-2-5-9-13)14-10-6-3-7-11-14/h2-11,16H,12H2,1H3.
What are the key properties of 3-methoxy-1,1-diphenylpropan-2-one?
3-methoxy-1,1-diphenylpropan-2-one has a molecular weight of 240.30 g/mol, XLogP of 3.03, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1,1-diphenylpropan-2-one is sourced from PubChem (CID 19419205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).