1-(4-methylphenyl)-N-phenylmethanimine

C14H13N — CID 525732

IUPAC1-(4-methylphenyl)-N-phenylmethanimine
SMILESCc1ccc(/C=N/c2ccccc2)cc1
InChIInChI=1S/C14H13N/c1-12-7-9-13(10-8-12)11-15-14-5-3-2-4-6-14/h2-11H,1H3/b15-11+
InChIKeyPCICJNSIYHONRK-RVDMUPIBSA-N
MW195.26 g/mol
LogP3.75
Rot. Bonds2

About 1-(4-methylphenyl)-N-phenylmethanimine

1-(4-methylphenyl)-N-phenylmethanimine (PubChem CID 525732) has the molecular formula C14H13N and a molecular weight of 195.26 g/mol. Its IUPAC name is 1-(4-methylphenyl)-N-phenylmethanimine.

Molecular Properties

Compound Name1-(4-methylphenyl)-N-phenylmethanimine
PubChem CID525732
Molecular FormulaC14H13N
Molecular Weight195.26 g/mol
Exact Mass195.10
IUPAC Name1-(4-methylphenyl)-N-phenylmethanimine
SMILESCc1ccc(/C=N/c2ccccc2)cc1
InChIInChI=1S/C14H13N/c1-12-7-9-13(10-8-12)11-15-14-5-3-2-4-6-14/h2-11H,1H3/b15-11+
InChIKeyPCICJNSIYHONRK-RVDMUPIBSA-N
XLogP3.75
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 53.75
H-Bond Donors ≤ 50
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 1-(4-methylphenyl)-N-phenylmethanimine?
The IUPAC name of 1-(4-methylphenyl)-N-phenylmethanimine (CID 525732) is 1-(4-methylphenyl)-N-phenylmethanimine.
What is the SMILES notation for 1-(4-methylphenyl)-N-phenylmethanimine?
The canonical SMILES for 1-(4-methylphenyl)-N-phenylmethanimine is Cc1ccc(/C=N/c2ccccc2)cc1.
What is the InChIKey of 1-(4-methylphenyl)-N-phenylmethanimine?
The InChIKey is PCICJNSIYHONRK-RVDMUPIBSA-N. The full InChI is InChI=1S/C14H13N/c1-12-7-9-13(10-8-12)11-15-14-5-3-2-4-6-14/h2-11H,1H3/b15-11+.
What are the key properties of 1-(4-methylphenyl)-N-phenylmethanimine?
1-(4-methylphenyl)-N-phenylmethanimine has a molecular weight of 195.26 g/mol, XLogP of 3.75, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylphenyl)-N-phenylmethanimine is sourced from PubChem (CID 525732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).