2-[[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol

C14H14N4O — CID 114332643

IUPAC2-[[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol
SMILESCc1cccn2nc(NCc3ccccc3O)nc12
InChIInChI=1S/C14H14N4O/c1-10-5-4-8-18-13(10)16-14(17-18)15-9-11-6-2-3-7-12(11)19/h2-8,19H,9H2,1H3,(H,15,17)
InChIKeyIOTULVFWTUEZFZ-UHFFFAOYSA-N
MW254.29 g/mol
LogP2.36
Rot. Bonds3

About 2-[[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol

2-[[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol (PubChem CID 114332643) has the molecular formula C14H14N4O and a molecular weight of 254.29 g/mol. Its IUPAC name is 2-[[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol.

Molecular Properties

Compound Name2-[[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol
PubChem CID114332643
Molecular FormulaC14H14N4O
Molecular Weight254.29 g/mol
Exact Mass254.12
IUPAC Name2-[[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol
SMILESCc1cccn2nc(NCc3ccccc3O)nc12
InChIInChI=1S/C14H14N4O/c1-10-5-4-8-18-13(10)16-14(17-18)15-9-11-6-2-3-7-12(11)19/h2-8,19H,9H2,1H3,(H,15,17)
InChIKeyIOTULVFWTUEZFZ-UHFFFAOYSA-N
XLogP2.36
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.29
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

Analyze 2-[[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol 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

N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 106374088
2-[[(7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol
CID 114332664
N-hex-5-ynyl-8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 106214508
2-[(2-methylphenyl)methyl]-[1,2,4]triazolo[1,5-a]pyridin-8-ol
CID 117137351
2-[(2-methylanilino)methyl]phenol
CID 3240149
8-methyl-N-[(2-methylcyclopentyl)methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 107419336
N-methyl-1-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)methanamine
CID 83866288
8-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 114184520
2-[(2,6-dimethylanilino)methyl]phenol
CID 4863460
2-[(2,3-dimethylanilino)methyl]phenol
CID 3236047
8-bromo-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 115990428
2-[[[1-(2-hydroxyethyl)-3-(2-methylphenyl)pyrazol-5-yl]amino]methyl]phenol
CID 110928739

Frequently Asked Questions

What is the IUPAC name of 2-[[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol?
The IUPAC name of 2-[[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol (CID 114332643) is 2-[[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol.
What is the SMILES notation for 2-[[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol?
The canonical SMILES for 2-[[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol is Cc1cccn2nc(NCc3ccccc3O)nc12.
What is the InChIKey of 2-[[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol?
The InChIKey is IOTULVFWTUEZFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4O/c1-10-5-4-8-18-13(10)16-14(17-18)15-9-11-6-2-3-7-12(11)19/h2-8,19H,9H2,1H3,(H,15,17).
What are the key properties of 2-[[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol?
2-[[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol has a molecular weight of 254.29 g/mol, XLogP of 2.36, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)amino]methyl]phenol is sourced from PubChem (CID 114332643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).