(6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene

C12H14O — CID 142213123

IUPAC(6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene
SMILESC=C/C(OC)=c1/c(C)cccc1=C
InChIInChI=1S/C12H14O/c1-5-11(13-4)12-9(2)7-6-8-10(12)3/h5-8H,1-2H2,3-4H3/b12-11-
InChIKeyCYKFTBYSTDEZTL-QXMHVHEDSA-N
MW174.24 g/mol
LogP1.35
Rot. Bonds2

About (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene

(6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene (PubChem CID 142213123) has the molecular formula C12H14O and a molecular weight of 174.24 g/mol. Its IUPAC name is (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene.

Molecular Properties

Compound Name(6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene
PubChem CID142213123
Molecular FormulaC12H14O
Molecular Weight174.24 g/mol
Exact Mass174.10
IUPAC Name(6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene
SMILESC=C/C(OC)=c1/c(C)cccc1=C
InChIInChI=1S/C12H14O/c1-5-11(13-4)12-9(2)7-6-8-10(12)3/h5-8H,1-2H2,3-4H3/b12-11-
InChIKeyCYKFTBYSTDEZTL-QXMHVHEDSA-N
XLogP1.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.24
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-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

2-[(6E)-6-(1-methoxyprop-2-enylidene)-5-methylidenecyclohexa-1,3-dien-1-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 159957998
prop-2-enoic acid;bis(1,2-xylene)
CID 175543794
(5Z)-5-[(2Z)-2-methoxy-3-methylpenta-2,4-dienylidene]-6-methylidenecyclohexa-1,3-diene
CID 142154594
1-(5-methylnaphthalen-1-yl)prop-2-en-1-one
CID 89106757
benzene-1,4-diol;methoxymethane;prop-2-enoic acid
CID 67882333
[(2,6-dimethylphenyl)-methoxymethylidene]chromium
CID 134972915
(1E)-5-methyl-2-methylidene-1-prop-2-enylidenenaphthalene
CID 143232097
N-(3-methyl-2-propan-2-ylphenyl)prop-2-enamide
CID 177272489
1-buta-1,3-dien-2-yloxy-2-methylbenzene
CID 123651418
ethane;1,2,3-trimethylbenzene
CID 54068667
benzene;1,2,3-trimethylbenzene
CID 159605245
acetylene;2-ethenyl-1,3-dimethylbenzene
CID 142972019

Frequently Asked Questions

What is the IUPAC name of (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene?
The IUPAC name of (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene (CID 142213123) is (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene.
What is the SMILES notation for (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene?
The canonical SMILES for (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene is C=C/C(OC)=c1/c(C)cccc1=C.
What is the InChIKey of (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene?
The InChIKey is CYKFTBYSTDEZTL-QXMHVHEDSA-N. The full InChI is InChI=1S/C12H14O/c1-5-11(13-4)12-9(2)7-6-8-10(12)3/h5-8H,1-2H2,3-4H3/b12-11-.
What are the key properties of (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene?
(6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene has a molecular weight of 174.24 g/mol, XLogP of 1.35, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6E)-6-(1-methoxyprop-2-enylidene)-1-methyl-5-methylidenecyclohexa-1,3-diene is sourced from PubChem (CID 142213123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).