4-[(2,4-dimethylphenyl)iminomethyl]phenol

C15H15NO — CID 137138686

IUPAC4-[(2,4-dimethylphenyl)iminomethyl]phenol
SMILESCc1ccc(/N=C/c2ccc(O)cc2)c(C)c1
InChIInChI=1S/C15H15NO/c1-11-3-8-15(12(2)9-11)16-10-13-4-6-14(17)7-5-13/h3-10,17H,1-2H3/b16-10+
InChIKeyODCUYUWTJFISGI-MHWRWJLKSA-N
MW225.29 g/mol
LogP3.76
Rot. Bonds2

About 4-[(2,4-dimethylphenyl)iminomethyl]phenol

4-[(2,4-dimethylphenyl)iminomethyl]phenol (PubChem CID 137138686) has the molecular formula C15H15NO and a molecular weight of 225.29 g/mol. Its IUPAC name is 4-[(2,4-dimethylphenyl)iminomethyl]phenol.

Molecular Properties

Compound Name4-[(2,4-dimethylphenyl)iminomethyl]phenol
PubChem CID137138686
Molecular FormulaC15H15NO
Molecular Weight225.29 g/mol
Exact Mass225.12
IUPAC Name4-[(2,4-dimethylphenyl)iminomethyl]phenol
SMILESCc1ccc(/N=C/c2ccc(O)cc2)c(C)c1
InChIInChI=1S/C15H15NO/c1-11-3-8-15(12(2)9-11)16-10-13-4-6-14(17)7-5-13/h3-10,17H,1-2H3/b16-10+
InChIKeyODCUYUWTJFISGI-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 4-[(2,4-dimethylphenyl)iminomethyl]phenol?
The IUPAC name of 4-[(2,4-dimethylphenyl)iminomethyl]phenol (CID 137138686) is 4-[(2,4-dimethylphenyl)iminomethyl]phenol.
What is the SMILES notation for 4-[(2,4-dimethylphenyl)iminomethyl]phenol?
The canonical SMILES for 4-[(2,4-dimethylphenyl)iminomethyl]phenol is Cc1ccc(/N=C/c2ccc(O)cc2)c(C)c1.
What is the InChIKey of 4-[(2,4-dimethylphenyl)iminomethyl]phenol?
The InChIKey is ODCUYUWTJFISGI-MHWRWJLKSA-N. The full InChI is InChI=1S/C15H15NO/c1-11-3-8-15(12(2)9-11)16-10-13-4-6-14(17)7-5-13/h3-10,17H,1-2H3/b16-10+.
What are the key properties of 4-[(2,4-dimethylphenyl)iminomethyl]phenol?
4-[(2,4-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 4-[(2,4-dimethylphenyl)iminomethyl]phenol is sourced from PubChem (CID 137138686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).