2-[(3,5-dimethylphenyl)iminomethyl]phenol

C15H15NO — CID 4108135

IUPAC2-[(3,5-dimethylphenyl)iminomethyl]phenol
SMILESCc1cc(C)cc(/N=C/c2ccccc2O)c1
InChIInChI=1S/C15H15NO/c1-11-7-12(2)9-14(8-11)16-10-13-5-3-4-6-15(13)17/h3-10,17H,1-2H3/b16-10+
InChIKeyCYZZXVVZGARMGX-MHWRWJLKSA-N
MW225.29 g/mol
LogP3.76
Rot. Bonds2

About 2-[(3,5-dimethylphenyl)iminomethyl]phenol

2-[(3,5-dimethylphenyl)iminomethyl]phenol (PubChem CID 4108135) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is 2-[(3,5-dimethylphenyl)iminomethyl]phenol.

Molecular Properties

Compound Name2-[(3,5-dimethylphenyl)iminomethyl]phenol
PubChem CID4108135
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name2-[(3,5-dimethylphenyl)iminomethyl]phenol
SMILESCc1cc(C)cc(/N=C/c2ccccc2O)c1
InChIInChI=1S/C15H15NO/c1-11-7-12(2)9-14(8-11)16-10-13-5-3-4-6-15(13)17/h3-10,17H,1-2H3/b16-10+
InChIKeyCYZZXVVZGARMGX-MHWRWJLKSA-N
XLogP3.76
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-[(3,5-dimethylphenyl)iminomethyl]phenol?
The IUPAC name of 2-[(3,5-dimethylphenyl)iminomethyl]phenol (CID 4108135) is 2-[(3,5-dimethylphenyl)iminomethyl]phenol.
What is the SMILES notation for 2-[(3,5-dimethylphenyl)iminomethyl]phenol?
The canonical SMILES for 2-[(3,5-dimethylphenyl)iminomethyl]phenol is Cc1cc(C)cc(/N=C/c2ccccc2O)c1.
What is the InChIKey of 2-[(3,5-dimethylphenyl)iminomethyl]phenol?
The InChIKey is CYZZXVVZGARMGX-MHWRWJLKSA-N. The full InChI is InChI=1S/C15H15NO/c1-11-7-12(2)9-14(8-11)16-10-13-5-3-4-6-15(13)17/h3-10,17H,1-2H3/b16-10+.
What are the key properties of 2-[(3,5-dimethylphenyl)iminomethyl]phenol?
2-[(3,5-dimethylphenyl)iminomethyl]phenol has a molecular weight of 225.29 g/mol, XLogP of 3.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3,5-dimethylphenyl)iminomethyl]phenol is sourced from PubChem (CID 4108135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).