1-methyl-3-(2-prop-1-en-2-ylphenyl)benzene

C16H16 — CID 145437903

IUPAC1-methyl-3-(2-prop-1-en-2-ylphenyl)benzene
SMILESC=C(C)c1ccccc1-c1cccc(C)c1
InChIInChI=1S/C16H16/c1-12(2)15-9-4-5-10-16(15)14-8-6-7-13(3)11-14/h4-11H,1H2,2-3H3
InChIKeyQECRVUXIYIQGQP-UHFFFAOYSA-N
MW208.30 g/mol
LogP4.70
Rot. Bonds2

About 1-methyl-3-(2-prop-1-en-2-ylphenyl)benzene

1-methyl-3-(2-prop-1-en-2-ylphenyl)benzene (PubChem CID 145437903) has the molecular formula C16H16 and a molecular weight of 208.30 g/mol. Its IUPAC name is 1-methyl-3-(2-prop-1-en-2-ylphenyl)benzene.

Molecular Properties

Compound Name1-methyl-3-(2-prop-1-en-2-ylphenyl)benzene
PubChem CID145437903
Molecular FormulaC16H16
Molecular Weight208.30 g/mol
Exact Mass208.13
IUPAC Name1-methyl-3-(2-prop-1-en-2-ylphenyl)benzene
SMILESC=C(C)c1ccccc1-c1cccc(C)c1
InChIInChI=1S/C16H16/c1-12(2)15-9-4-5-10-16(15)14-8-6-7-13(3)11-14/h4-11H,1H2,2-3H3
InChIKeyQECRVUXIYIQGQP-UHFFFAOYSA-N
XLogP4.70
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 54.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1-methyl-3-(2-prop-1-en-2-ylphenyl)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-(3-methylphenyl)phenol
CID 11206198
2-bromo-1-[2-(3-methylphenyl)phenyl]ethanone
CID 87884829
1,2-bis(prop-1-en-2-yl)benzene;toluene
CID 173384676
1,2-diphenyl-3-prop-1-en-2-ylbenzene
CID 142394581
2-phenyl-6-prop-1-en-2-ylphenol
CID 154380547
N-methyl-2-(3-methylphenyl)aniline
CID 59454343
4-methyl-2-(3-methylphenyl)-1-[2-(3-methylphenyl)phenyl]benzene
CID 58892355
1,2-bis(prop-1-en-2-yl)benzene;1,4-xylene
CID 143494216
2-[2-methyl-3-(3-methylphenyl)phenyl]phenol
CID 121342890
2-bromo-1,3-bis(3-methylphenyl)benzene
CID 3691341
2-iodo-1,3-bis(3-methylphenyl)benzene
CID 170072024
2-(3-methylphenyl)-6-phenylaniline
CID 150906011

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(2-prop-1-en-2-ylphenyl)benzene?
The IUPAC name of 1-methyl-3-(2-prop-1-en-2-ylphenyl)benzene (CID 145437903) is 1-methyl-3-(2-prop-1-en-2-ylphenyl)benzene.
What is the SMILES notation for 1-methyl-3-(2-prop-1-en-2-ylphenyl)benzene?
The canonical SMILES for 1-methyl-3-(2-prop-1-en-2-ylphenyl)benzene is C=C(C)c1ccccc1-c1cccc(C)c1.
What is the InChIKey of 1-methyl-3-(2-prop-1-en-2-ylphenyl)benzene?
The InChIKey is QECRVUXIYIQGQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16/c1-12(2)15-9-4-5-10-16(15)14-8-6-7-13(3)11-14/h4-11H,1H2,2-3H3.
What are the key properties of 1-methyl-3-(2-prop-1-en-2-ylphenyl)benzene?
1-methyl-3-(2-prop-1-en-2-ylphenyl)benzene has a molecular weight of 208.30 g/mol, XLogP of 4.70, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(2-prop-1-en-2-ylphenyl)benzene is sourced from PubChem (CID 145437903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).