2-[1-(4-methoxyphenyl)ethenyl]-1,3-dimethylbenzene

C17H18O — CID 165346994

IUPAC2-[1-(4-methoxyphenyl)ethenyl]-1,3-dimethylbenzene
SMILESC=C(c1ccc(OC)cc1)c1c(C)cccc1C
InChIInChI=1S/C17H18O/c1-12-6-5-7-13(2)17(12)14(3)15-8-10-16(18-4)11-9-15/h5-11H,3H2,1-2,4H3
InChIKeyLKSLRLVLJPYVSQ-UHFFFAOYSA-N
MW238.33 g/mol
LogP4.37
Rot. Bonds3

About 2-[1-(4-methoxyphenyl)ethenyl]-1,3-dimethylbenzene

2-[1-(4-methoxyphenyl)ethenyl]-1,3-dimethylbenzene (PubChem CID 165346994) has the molecular formula C17H18O and a molecular weight of 238.33 g/mol. Its IUPAC name is 2-[1-(4-methoxyphenyl)ethenyl]-1,3-dimethylbenzene.

Molecular Properties

Compound Name2-[1-(4-methoxyphenyl)ethenyl]-1,3-dimethylbenzene
PubChem CID165346994
Molecular FormulaC17H18O
Molecular Weight238.33 g/mol
Exact Mass238.14
IUPAC Name2-[1-(4-methoxyphenyl)ethenyl]-1,3-dimethylbenzene
SMILESC=C(c1ccc(OC)cc1)c1c(C)cccc1C
InChIInChI=1S/C17H18O/c1-12-6-5-7-13(2)17(12)14(3)15-8-10-16(18-4)11-9-15/h5-11H,3H2,1-2,4H3
InChIKeyLKSLRLVLJPYVSQ-UHFFFAOYSA-N
XLogP4.37
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[1-(4-methoxyphenyl)ethenyl]-1,3,5-trimethylbenzene
CID 10890406
1-methoxy-4-[1-(2-methylphenyl)ethenyl]benzene
CID 25187424
2-ethenyl-1-[1-(4-methoxyphenyl)ethenyl]-3-methylbenzene
CID 143770467
1-methoxy-4-[4-[1-[4-(4-methoxyphenoxy)phenyl]ethenyl]phenoxy]benzene
CID 21292587
2,5-bis[1-(4-methoxyphenyl)ethenyl]-1H-pyrrole
CID 22971799
1-[1-(4-methoxyphenyl)ethenyl]-4-[4-(4-methylphenyl)phenoxy]benzene
CID 162199896
actinium;1-(4-methoxyphenyl)ethenol
CID 22892785
1-methoxy-3-[1-(2-methylphenyl)ethenyl]benzene
CID 102265187
1-[3,4-dimethylidene-5-(4-methylphenyl)hexa-1,5-dien-2-yl]-4-methoxybenzene
CID 162401228
N-(2,6-dimethylphenyl)-4-methoxybenzohydrazide
CID 174761410
1-[1-(4-methoxyphenyl)ethenyl]-4-nitrobenzene
CID 14961617
1-methoxy-4-[(3R,4S)-5-(4-methoxyphenyl)-3,4-dimethylhexa-1,5-dien-2-yl]benzene
CID 100960960

Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-methoxyphenyl)ethenyl]-1,3-dimethylbenzene?
The IUPAC name of 2-[1-(4-methoxyphenyl)ethenyl]-1,3-dimethylbenzene (CID 165346994) is 2-[1-(4-methoxyphenyl)ethenyl]-1,3-dimethylbenzene.
What is the SMILES notation for 2-[1-(4-methoxyphenyl)ethenyl]-1,3-dimethylbenzene?
The canonical SMILES for 2-[1-(4-methoxyphenyl)ethenyl]-1,3-dimethylbenzene is C=C(c1ccc(OC)cc1)c1c(C)cccc1C.
What is the InChIKey of 2-[1-(4-methoxyphenyl)ethenyl]-1,3-dimethylbenzene?
The InChIKey is LKSLRLVLJPYVSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O/c1-12-6-5-7-13(2)17(12)14(3)15-8-10-16(18-4)11-9-15/h5-11H,3H2,1-2,4H3.
What are the key properties of 2-[1-(4-methoxyphenyl)ethenyl]-1,3-dimethylbenzene?
2-[1-(4-methoxyphenyl)ethenyl]-1,3-dimethylbenzene has a molecular weight of 238.33 g/mol, XLogP of 4.37, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-methoxyphenyl)ethenyl]-1,3-dimethylbenzene is sourced from PubChem (CID 165346994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).