1,3-dimethyl-2-(3-phenyl-1-phenylmethoxypropyl)benzene

C24H26O — CID 154712363

IUPAC1,3-dimethyl-2-(3-phenyl-1-phenylmethoxypropyl)benzene
SMILESCc1cccc(C)c1C(CCc1ccccc1)OCc1ccccc1
InChIInChI=1S/C24H26O/c1-19-10-9-11-20(2)24(19)23(17-16-21-12-5-3-6-13-21)25-18-22-14-7-4-8-15-22/h3-15,23H,16-18H2,1-2H3
InChIKeyVJSWSHWHTIAOBG-UHFFFAOYSA-N
MW330.47 g/mol
LogP6.19
Rot. Bonds7

About 1,3-dimethyl-2-(3-phenyl-1-phenylmethoxypropyl)benzene

1,3-dimethyl-2-(3-phenyl-1-phenylmethoxypropyl)benzene (PubChem CID 154712363) has the molecular formula C24H26O and a molecular weight of 330.47 g/mol. Its IUPAC name is 1,3-dimethyl-2-(3-phenyl-1-phenylmethoxypropyl)benzene.

Molecular Properties

Compound Name1,3-dimethyl-2-(3-phenyl-1-phenylmethoxypropyl)benzene
PubChem CID154712363
Molecular FormulaC24H26O
Molecular Weight330.47 g/mol
Exact Mass330.20
IUPAC Name1,3-dimethyl-2-(3-phenyl-1-phenylmethoxypropyl)benzene
SMILESCc1cccc(C)c1C(CCc1ccccc1)OCc1ccccc1
InChIInChI=1S/C24H26O/c1-19-10-9-11-20(2)24(19)23(17-16-21-12-5-3-6-13-21)25-18-22-14-7-4-8-15-22/h3-15,23H,16-18H2,1-2H3
InChIKeyVJSWSHWHTIAOBG-UHFFFAOYSA-N
XLogP6.19
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.47
LogP ≤ 56.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1,3-dimethyl-2-(3-phenyl-1-phenylmethoxypropyl)benzene 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

2-methyl-8-(3-phenyl-1-phenylmethoxypropyl)quinoline
CID 102460472
phenyl-[4-(3-phenyl-1-phenylmethoxypropyl)phenyl]methanone
CID 102460465
1-(2-methylphenyl)-3-phenylpropan-1-amine
CID 54919026
[(Z)-1-phenylhex-4-en-3-yl]oxymethylbenzene
CID 23649924
6-(3-phenyl-1-phenylmethoxypropyl)quinoline
CID 102460471
1-(2-fluoro-3-methylphenyl)-3-phenylpropan-1-ol
CID 114979028
N-(1,3-diphenylpropoxy)-N-methylmethanamine
CID 13095117
N-[2-(3-methylphenyl)-2-phenylmethoxyethyl]propan-2-amine
CID 62106839
[1-(2-iodo-3-methylphenyl)-3-phenylpropyl]hydrazine
CID 114030517
N-[1-(2-methylphenyl)ethyl]-4-phenylbutan-2-amine
CID 43096454
N-[(1S)-1-(2-methylphenyl)ethyl]-4-phenylbutan-2-amine
CID 81374312
(E)-2-methyl-4-phenyl-N-phenylmethoxybutan-1-imine
CID 134997291

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-2-(3-phenyl-1-phenylmethoxypropyl)benzene?
The IUPAC name of 1,3-dimethyl-2-(3-phenyl-1-phenylmethoxypropyl)benzene (CID 154712363) is 1,3-dimethyl-2-(3-phenyl-1-phenylmethoxypropyl)benzene.
What is the SMILES notation for 1,3-dimethyl-2-(3-phenyl-1-phenylmethoxypropyl)benzene?
The canonical SMILES for 1,3-dimethyl-2-(3-phenyl-1-phenylmethoxypropyl)benzene is Cc1cccc(C)c1C(CCc1ccccc1)OCc1ccccc1.
What is the InChIKey of 1,3-dimethyl-2-(3-phenyl-1-phenylmethoxypropyl)benzene?
The InChIKey is VJSWSHWHTIAOBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26O/c1-19-10-9-11-20(2)24(19)23(17-16-21-12-5-3-6-13-21)25-18-22-14-7-4-8-15-22/h3-15,23H,16-18H2,1-2H3.
What are the key properties of 1,3-dimethyl-2-(3-phenyl-1-phenylmethoxypropyl)benzene?
1,3-dimethyl-2-(3-phenyl-1-phenylmethoxypropyl)benzene has a molecular weight of 330.47 g/mol, XLogP of 6.19, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-2-(3-phenyl-1-phenylmethoxypropyl)benzene is sourced from PubChem (CID 154712363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).