1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one

C24H24O2 — CID 24989559

IUPAC1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one
SMILESCOc1ccc(C(=O)CCCCc2ccccc2)cc1-c1ccccc1
InChIInChI=1S/C24H24O2/c1-26-24-17-16-21(18-22(24)20-13-6-3-7-14-20)23(25)15-9-8-12-19-10-4-2-5-11-19/h2-7,10-11,13-14,16-18H,8-9,12,15H2,1H3
InChIKeyMPSOYMADILEVML-UHFFFAOYSA-N
MW344.45 g/mol
LogP5.96
Rot. Bonds8

About 1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one

1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one (PubChem CID 24989559) has the molecular formula C24H24O2 and a molecular weight of 344.45 g/mol. Its IUPAC name is 1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one.

Molecular Properties

Compound Name1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one
PubChem CID24989559
Molecular FormulaC24H24O2
Molecular Weight344.45 g/mol
Exact Mass344.18
IUPAC Name1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one
SMILESCOc1ccc(C(=O)CCCCc2ccccc2)cc1-c1ccccc1
InChIInChI=1S/C24H24O2/c1-26-24-17-16-21(18-22(24)20-13-6-3-7-14-20)23(25)15-9-8-12-19-10-4-2-5-11-19/h2-7,10-11,13-14,16-18H,8-9,12,15H2,1H3
InChIKeyMPSOYMADILEVML-UHFFFAOYSA-N
XLogP5.96
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.45
LogP ≤ 55.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(4-methoxy-3-phenylphenyl)-2-methylidene-4-oxobutanoic acid
CID 70638858
methyl 4-methoxy-3-phenylbenzoate
CID 11010121
1-(3-fluoro-4-methoxyphenyl)-3-phenylpropan-1-one
CID 43474033
4-methoxy-N,N-dimethyl-3-phenylbenzamide
CID 49375903
1-[4-methoxy-3-(methylsulfanylamino)phenyl]-5-(2-phenylethylamino)pentan-1-one
CID 142261072
N-[2-methoxy-5-(3-phenylpropanoyl)phenyl]-2-methylpropanamide
CID 147906172
1-[4-[(6,7-dimethoxyquinolin-4-yl)methyl]phenyl]-5-phenylpentan-1-one
CID 58065102
2-(4-methoxy-3-phenylphenyl)ethanol
CID 117328990
4-methoxy-N-(4-methoxybutyl)-3-phenylbenzamide
CID 49326379
ethyl 2-[3-[5-(3-bromopropanoyl)-2-methoxyphenyl]phenyl]acetate
CID 11795555
4-[4-(5-fluoro-2-methoxyphenyl)phenyl]butanoic acid
CID 67208829
1-(3-bromo-4-methoxyphenyl)-2-phenylethanone
CID 43339868

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one?
The IUPAC name of 1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one (CID 24989559) is 1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one.
What is the SMILES notation for 1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one?
The canonical SMILES for 1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one is COc1ccc(C(=O)CCCCc2ccccc2)cc1-c1ccccc1.
What is the InChIKey of 1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one?
The InChIKey is MPSOYMADILEVML-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24O2/c1-26-24-17-16-21(18-22(24)20-13-6-3-7-14-20)23(25)15-9-8-12-19-10-4-2-5-11-19/h2-7,10-11,13-14,16-18H,8-9,12,15H2,1H3.
What are the key properties of 1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one?
1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one has a molecular weight of 344.45 g/mol, XLogP of 5.96, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-3-phenylphenyl)-5-phenylpentan-1-one is sourced from PubChem (CID 24989559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).