(2-ethenyl-4,6-dimethylphenyl)methanimine

C11H13N — CID 142023097

IUPAC(2-ethenyl-4,6-dimethylphenyl)methanimine
SMILES[H]/N=C/c1c(C)cc(C)cc1C=C
InChIInChI=1S/C11H13N/c1-4-10-6-8(2)5-9(3)11(10)7-12/h4-7,12H,1H2,2-3H3/b12-7+
InChIKeyWNOJSSNGZHVZSD-KPKJPENVSA-N
MW159.23 g/mol
LogP2.94
Rot. Bonds2

About (2-ethenyl-4,6-dimethylphenyl)methanimine

(2-ethenyl-4,6-dimethylphenyl)methanimine (PubChem CID 142023097) has the molecular formula C11H13N and a molecular weight of 159.23 g/mol. Its IUPAC name is (2-ethenyl-4,6-dimethylphenyl)methanimine.

Molecular Properties

Compound Name(2-ethenyl-4,6-dimethylphenyl)methanimine
PubChem CID142023097
Molecular FormulaC11H13N
Molecular Weight159.23 g/mol
Exact Mass159.10
IUPAC Name(2-ethenyl-4,6-dimethylphenyl)methanimine
SMILES[H]/N=C/c1c(C)cc(C)cc1C=C
InChIInChI=1S/C11H13N/c1-4-10-6-8(2)5-9(3)11(10)7-12/h4-7,12H,1H2,2-3H3/b12-7+
InChIKeyWNOJSSNGZHVZSD-KPKJPENVSA-N
XLogP2.94
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.23
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(2-ethenyl-6-methylphenyl)methanimine
CID 156888236
2-ethenyl-1,3,5-trimethylbenzene
CID 158735169
(2-methoxy-3,5-dimethylphenyl)methanimine
CID 176965340
4-methanimidoyl-5-methylbenzene-1,3-diol
CID 142579272
1-chloro-2-ethenyl-3,5-dimethylbenzene
CID 143091149
2-chloro-6-methanimidoyl-4-methylphenol
CID 143431027
(2-ethenyl-4,6-dimethylphenyl)-(2,4,6-trimethylphenyl)borinic acid
CID 89337675
1-ethenyl-2,4-dimethylbenzene
CID 157285903
(3-ethenyl-4-methylfuran-2-yl)methanimine
CID 167500331
3-bromo-2-methanimidoyl-5-methylaniline
CID 142352138
2-ethenyl-1,5-dimethyl-3-prop-1-en-2-ylbenzene
CID 145238081
3,5-dimethylphthalaldehyde
CID 23156924

Frequently Asked Questions

What is the IUPAC name of (2-ethenyl-4,6-dimethylphenyl)methanimine?
The IUPAC name of (2-ethenyl-4,6-dimethylphenyl)methanimine (CID 142023097) is (2-ethenyl-4,6-dimethylphenyl)methanimine.
What is the SMILES notation for (2-ethenyl-4,6-dimethylphenyl)methanimine?
The canonical SMILES for (2-ethenyl-4,6-dimethylphenyl)methanimine is [H]/N=C/c1c(C)cc(C)cc1C=C.
What is the InChIKey of (2-ethenyl-4,6-dimethylphenyl)methanimine?
The InChIKey is WNOJSSNGZHVZSD-KPKJPENVSA-N. The full InChI is InChI=1S/C11H13N/c1-4-10-6-8(2)5-9(3)11(10)7-12/h4-7,12H,1H2,2-3H3/b12-7+.
What are the key properties of (2-ethenyl-4,6-dimethylphenyl)methanimine?
(2-ethenyl-4,6-dimethylphenyl)methanimine has a molecular weight of 159.23 g/mol, XLogP of 2.94, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethenyl-4,6-dimethylphenyl)methanimine is sourced from PubChem (CID 142023097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).