(2-methylphenyl)-phenylmethanimine

C14H13N — CID 3104923

IUPAC(2-methylphenyl)-phenylmethanimine
SMILES[H]/N=C(\c1ccccc1)c1ccccc1C
InChIInChI=1S/C14H13N/c1-11-7-5-6-10-13(11)14(15)12-8-3-2-4-9-12/h2-10,15H,1H3/b15-14+
InChIKeyCODBILKKNFIKDG-CCEZHUSRSA-N
MW195.27 g/mol
LogP3.41
Rot. Bonds2

About (2-methylphenyl)-phenylmethanimine

(2-methylphenyl)-phenylmethanimine (PubChem CID 3104923) has the molecular formula C14H13N and a molecular weight of 195.27 g/mol. Its IUPAC name is (2-methylphenyl)-phenylmethanimine.

Molecular Properties

Compound Name(2-methylphenyl)-phenylmethanimine
PubChem CID3104923
Molecular FormulaC14H13N
Molecular Weight195.27 g/mol
Exact Mass195.10
IUPAC Name(2-methylphenyl)-phenylmethanimine
SMILES[H]/N=C(\c1ccccc1)c1ccccc1C
InChIInChI=1S/C14H13N/c1-11-7-5-6-10-13(11)14(15)12-8-3-2-4-9-12/h2-10,15H,1H3/b15-14+
InChIKeyCODBILKKNFIKDG-CCEZHUSRSA-N
XLogP3.41
TPSA23.85 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.27
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2-methylphenyl)-phenylmethanimine?
The IUPAC name of (2-methylphenyl)-phenylmethanimine (CID 3104923) is (2-methylphenyl)-phenylmethanimine.
What is the SMILES notation for (2-methylphenyl)-phenylmethanimine?
The canonical SMILES for (2-methylphenyl)-phenylmethanimine is [H]/N=C(\c1ccccc1)c1ccccc1C.
What is the InChIKey of (2-methylphenyl)-phenylmethanimine?
The InChIKey is CODBILKKNFIKDG-CCEZHUSRSA-N. The full InChI is InChI=1S/C14H13N/c1-11-7-5-6-10-13(11)14(15)12-8-3-2-4-9-12/h2-10,15H,1H3/b15-14+.
What are the key properties of (2-methylphenyl)-phenylmethanimine?
(2-methylphenyl)-phenylmethanimine has a molecular weight of 195.27 g/mol, XLogP of 3.41, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylphenyl)-phenylmethanimine is sourced from PubChem (CID 3104923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).