5-methoxy-6-methylidene-1-phenylcyclohexa-1,3-diene

C14H14O — CID 141284582

IUPAC5-methoxy-6-methylidene-1-phenylcyclohexa-1,3-diene
SMILESC=C1C(c2ccccc2)=CC=CC1OC
InChIInChI=1S/C14H14O/c1-11-13(9-6-10-14(11)15-2)12-7-4-3-5-8-12/h3-10,14H,1H2,2H3
InChIKeyGPFAAMHPVZJQIO-UHFFFAOYSA-N
MW198.26 g/mol
LogP3.21
Rot. Bonds2

About 5-methoxy-6-methylidene-1-phenylcyclohexa-1,3-diene

5-methoxy-6-methylidene-1-phenylcyclohexa-1,3-diene (PubChem CID 141284582) has the molecular formula C14H14O and a molecular weight of 198.26 g/mol. Its IUPAC name is 5-methoxy-6-methylidene-1-phenylcyclohexa-1,3-diene.

Molecular Properties

Compound Name5-methoxy-6-methylidene-1-phenylcyclohexa-1,3-diene
PubChem CID141284582
Molecular FormulaC14H14O
Molecular Weight198.26 g/mol
Exact Mass198.10
IUPAC Name5-methoxy-6-methylidene-1-phenylcyclohexa-1,3-diene
SMILESC=C1C(c2ccccc2)=CC=CC1OC
InChIInChI=1S/C14H14O/c1-11-13(9-6-10-14(11)15-2)12-7-4-3-5-8-12/h3-10,14H,1H2,2H3
InChIKeyGPFAAMHPVZJQIO-UHFFFAOYSA-N
XLogP3.21
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.26
LogP ≤ 53.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 5-methoxy-6-methylidene-1-phenylcyclohexa-1,3-diene 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

6-chloro-5-methylidene-4-phenylcyclohexa-1,3-dien-1-amine
CID 175593862
ditert-butyl-(5-methoxycyclopenta-1,3-dien-1-yl)phosphane
CID 174784035
4-methoxy-2-phenyl-4H-selenochromene
CID 15495831
bis(8-tert-butyl-2-methyl-4-phenyl-1,8-dihydroazulen-1-yl)-dimethylsilane
CID 101367915
1,1'-biphenyl;methoxyphosphane
CID 69051753
1,1-dimethoxy-4-methylidene-2,6-diphenylphosphinin-1-ium
CID 134881053
(5-propan-2-ylcyclopenta-1,3-dien-1-yl)benzene
CID 175483220
cyclobutadienylbenzene
CID 86042442
1-phenyl-6-propan-2-ylidenecyclohexa-1,3-diene
CID 21263485
benzene;1,1'-biphenyl;ethane
CID 158550617
1-methoxy-4-[(2-phenylcyclohexa-2,4-dien-1-ylidene)methyl]benzene
CID 175596767
5-fluoro-2-methyl-1-phenylcyclohexa-1,3-diene
CID 154971229

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-6-methylidene-1-phenylcyclohexa-1,3-diene?
The IUPAC name of 5-methoxy-6-methylidene-1-phenylcyclohexa-1,3-diene (CID 141284582) is 5-methoxy-6-methylidene-1-phenylcyclohexa-1,3-diene.
What is the SMILES notation for 5-methoxy-6-methylidene-1-phenylcyclohexa-1,3-diene?
The canonical SMILES for 5-methoxy-6-methylidene-1-phenylcyclohexa-1,3-diene is C=C1C(c2ccccc2)=CC=CC1OC.
What is the InChIKey of 5-methoxy-6-methylidene-1-phenylcyclohexa-1,3-diene?
The InChIKey is GPFAAMHPVZJQIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O/c1-11-13(9-6-10-14(11)15-2)12-7-4-3-5-8-12/h3-10,14H,1H2,2H3.
What are the key properties of 5-methoxy-6-methylidene-1-phenylcyclohexa-1,3-diene?
5-methoxy-6-methylidene-1-phenylcyclohexa-1,3-diene has a molecular weight of 198.26 g/mol, XLogP of 3.21, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-6-methylidene-1-phenylcyclohexa-1,3-diene is sourced from PubChem (CID 141284582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).