2-methylphenol;triazine

C10H11N3O — CID 66780120

IUPAC2-methylphenol;triazine
SMILESCc1ccccc1O.c1cnnnc1
InChIInChI=1S/C7H8O.C3H3N3/c1-6-4-2-3-5-7(6)8;1-2-4-6-5-3-1/h2-5,8H,1H3;1-3H
InChIKeyRTMOGILUJKYLPF-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.57
Rot. Bonds

About 2-methylphenol;triazine

2-methylphenol;triazine (PubChem CID 66780120) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 2-methylphenol;triazine.

Molecular Properties

Compound Name2-methylphenol;triazine
PubChem CID66780120
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name2-methylphenol;triazine
SMILESCc1ccccc1O.c1cnnnc1
InChIInChI=1S/C7H8O.C3H3N3/c1-6-4-2-3-5-7(6)8;1-2-4-6-5-3-1/h2-5,8H,1H3;1-3H
InChIKeyRTMOGILUJKYLPF-UHFFFAOYSA-N
XLogP1.57
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-methylphenol;triazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methylphenol;triazine?
The IUPAC name of 2-methylphenol;triazine (CID 66780120) is 2-methylphenol;triazine.
What is the SMILES notation for 2-methylphenol;triazine?
The canonical SMILES for 2-methylphenol;triazine is Cc1ccccc1O.c1cnnnc1.
What is the InChIKey of 2-methylphenol;triazine?
The InChIKey is RTMOGILUJKYLPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8O.C3H3N3/c1-6-4-2-3-5-7(6)8;1-2-4-6-5-3-1/h2-5,8H,1H3;1-3H.
What are the key properties of 2-methylphenol;triazine?
2-methylphenol;triazine has a molecular weight of 189.22 g/mol, XLogP of 1.57, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylphenol;triazine is sourced from PubChem (CID 66780120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).