6-methyl-2-[[2-(1,2,4-triazol-1-yl)anilino]methyl]pyridin-3-ol

C15H15N5O — CID 79156738

IUPAC6-methyl-2-[[2-(1,2,4-triazol-1-yl)anilino]methyl]pyridin-3-ol
SMILESCc1ccc(O)c(CNc2ccccc2-n2cncn2)n1
InChIInChI=1S/C15H15N5O/c1-11-6-7-15(21)13(19-11)8-17-12-4-2-3-5-14(12)20-10-16-9-18-20/h2-7,9-10,17,21H,8H2,1H3
InChIKeyUHMHNXLMWDTGON-UHFFFAOYSA-N
MW281.32 g/mol
LogP2.29
Rot. Bonds4

About 6-methyl-2-[[2-(1,2,4-triazol-1-yl)anilino]methyl]pyridin-3-ol

6-methyl-2-[[2-(1,2,4-triazol-1-yl)anilino]methyl]pyridin-3-ol (PubChem CID 79156738) has the molecular formula C15H15N5O and a molecular weight of 281.32 g/mol. Its IUPAC name is 6-methyl-2-[[2-(1,2,4-triazol-1-yl)anilino]methyl]pyridin-3-ol.

Molecular Properties

Compound Name6-methyl-2-[[2-(1,2,4-triazol-1-yl)anilino]methyl]pyridin-3-ol
PubChem CID79156738
Molecular FormulaC15H15N5O
Molecular Weight281.32 g/mol
Exact Mass281.13
IUPAC Name6-methyl-2-[[2-(1,2,4-triazol-1-yl)anilino]methyl]pyridin-3-ol
SMILESCc1ccc(O)c(CNc2ccccc2-n2cncn2)n1
InChIInChI=1S/C15H15N5O/c1-11-6-7-15(21)13(19-11)8-17-12-4-2-3-5-14(12)20-10-16-9-18-20/h2-7,9-10,17,21H,8H2,1H3
InChIKeyUHMHNXLMWDTGON-UHFFFAOYSA-N
XLogP2.29
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.32
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-methyl-2-[[2-(1,2,4-triazol-1-yl)anilino]methyl]pyridin-3-ol with MolForge

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

Launch Full Analysis

Related Compounds

2-[(2-iodoanilino)methyl]-6-methylpyridin-3-ol
CID 79162332
N-[(5-methyl-1H-imidazol-4-yl)methyl]-2-(1,2,4-triazol-1-yl)aniline
CID 62749408
3-[[2-(1,2,4-triazol-1-yl)anilino]methyl]benzene-1,2-diol
CID 61318676
2-methyl-6-[[2-(1,2,4-triazol-1-yl)anilino]methyl]phenol
CID 115951256
N-[(2-methylphenyl)methyl]-2-(1,2,4-triazol-1-yl)aniline
CID 43426538
6-methyl-2-[(naphthalen-1-ylamino)methyl]pyridin-3-ol
CID 79163427
2-bromo-4-[[2-(1,2,4-triazol-1-yl)anilino]methyl]phenol
CID 63047079
N-[(3,4-dimethylphenyl)methyl]-2-(1,2,4-triazol-1-yl)aniline
CID 43784452
N-[(5-methyl-1H-pyrazol-4-yl)methyl]-2-(1,2,4-triazol-1-yl)aniline
CID 43711706
2-chloro-6-[[2-(1,2,4-triazol-1-yl)anilino]methyl]phenol
CID 115951257
N-(4-methylsulfanylbutyl)-2-(1,2,4-triazol-1-yl)aniline
CID 103087546
N-[(1-methylpyrrol-3-yl)methyl]-2-(1,2,4-triazol-1-yl)aniline
CID 66398320

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-[[2-(1,2,4-triazol-1-yl)anilino]methyl]pyridin-3-ol?
The IUPAC name of 6-methyl-2-[[2-(1,2,4-triazol-1-yl)anilino]methyl]pyridin-3-ol (CID 79156738) is 6-methyl-2-[[2-(1,2,4-triazol-1-yl)anilino]methyl]pyridin-3-ol.
What is the SMILES notation for 6-methyl-2-[[2-(1,2,4-triazol-1-yl)anilino]methyl]pyridin-3-ol?
The canonical SMILES for 6-methyl-2-[[2-(1,2,4-triazol-1-yl)anilino]methyl]pyridin-3-ol is Cc1ccc(O)c(CNc2ccccc2-n2cncn2)n1.
What is the InChIKey of 6-methyl-2-[[2-(1,2,4-triazol-1-yl)anilino]methyl]pyridin-3-ol?
The InChIKey is UHMHNXLMWDTGON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N5O/c1-11-6-7-15(21)13(19-11)8-17-12-4-2-3-5-14(12)20-10-16-9-18-20/h2-7,9-10,17,21H,8H2,1H3.
What are the key properties of 6-methyl-2-[[2-(1,2,4-triazol-1-yl)anilino]methyl]pyridin-3-ol?
6-methyl-2-[[2-(1,2,4-triazol-1-yl)anilino]methyl]pyridin-3-ol has a molecular weight of 281.32 g/mol, XLogP of 2.29, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-[[2-(1,2,4-triazol-1-yl)anilino]methyl]pyridin-3-ol is sourced from PubChem (CID 79156738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).