1-(3-methoxyphenyl)triazolo[4,5-c]pyridine

C12H10N4O — CID 117159499

IUPAC1-(3-methoxyphenyl)triazolo[4,5-c]pyridine
SMILESCOc1cccc(-n2nnc3cnccc32)c1
InChIInChI=1S/C12H10N4O/c1-17-10-4-2-3-9(7-10)16-12-5-6-13-8-11(12)14-15-16/h2-8H,1H3
InChIKeyXFTMOQKCGLQENB-UHFFFAOYSA-N
MW226.24 g/mol
LogP1.82
Rot. Bonds2

About 1-(3-methoxyphenyl)triazolo[4,5-c]pyridine

1-(3-methoxyphenyl)triazolo[4,5-c]pyridine (PubChem CID 117159499) has the molecular formula C12H10N4O and a molecular weight of 226.24 g/mol. Its IUPAC name is 1-(3-methoxyphenyl)triazolo[4,5-c]pyridine.

Molecular Properties

Compound Name1-(3-methoxyphenyl)triazolo[4,5-c]pyridine
PubChem CID117159499
Molecular FormulaC12H10N4O
Molecular Weight226.24 g/mol
Exact Mass226.09
IUPAC Name1-(3-methoxyphenyl)triazolo[4,5-c]pyridine
SMILESCOc1cccc(-n2nnc3cnccc32)c1
InChIInChI=1S/C12H10N4O/c1-17-10-4-2-3-9(7-10)16-12-5-6-13-8-11(12)14-15-16/h2-8H,1H3
InChIKeyXFTMOQKCGLQENB-UHFFFAOYSA-N
XLogP1.82
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.24
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3-methoxyphenyl)benzotriazole-5-carboxylic acid
CID 29077186
4-(triazolo[4,5-c]pyridin-1-yl)aniline
CID 117159529
1-(3-methoxyphenyl)-3H-imidazo[4,5-c]pyridine-2-thione
CID 79296550
[3-(5-methoxybenzotriazol-1-yl)phenyl]sulfamoyl carbamate
CID 175462596
3-(3-methoxyphenyl)triazol-4-amine
CID 105444137
N-methyltriazolo[4,5-c]pyridin-1-amine
CID 70365902
(1S)-1-[4-(5-methoxybenzotriazol-1-yl)phenyl]ethanamine
CID 164599725
1-(2-bromophenyl)triazolo[4,5-c]pyridine
CID 117159503
1-(3-methoxyphenyl)-5-propan-2-yltriazol-4-amine
CID 79501179
[1-(3-methoxyphenyl)-5-methyltriazol-4-yl]methanamine
CID 28911796
5-bromo-1-(3-methoxyphenyl)pyrazole
CID 112693887
2-methoxy-4-(6-methoxybenzotriazol-1-yl)phenol
CID 132608233

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxyphenyl)triazolo[4,5-c]pyridine?
The IUPAC name of 1-(3-methoxyphenyl)triazolo[4,5-c]pyridine (CID 117159499) is 1-(3-methoxyphenyl)triazolo[4,5-c]pyridine.
What is the SMILES notation for 1-(3-methoxyphenyl)triazolo[4,5-c]pyridine?
The canonical SMILES for 1-(3-methoxyphenyl)triazolo[4,5-c]pyridine is COc1cccc(-n2nnc3cnccc32)c1.
What is the InChIKey of 1-(3-methoxyphenyl)triazolo[4,5-c]pyridine?
The InChIKey is XFTMOQKCGLQENB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4O/c1-17-10-4-2-3-9(7-10)16-12-5-6-13-8-11(12)14-15-16/h2-8H,1H3.
What are the key properties of 1-(3-methoxyphenyl)triazolo[4,5-c]pyridine?
1-(3-methoxyphenyl)triazolo[4,5-c]pyridine has a molecular weight of 226.24 g/mol, XLogP of 1.82, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxyphenyl)triazolo[4,5-c]pyridine is sourced from PubChem (CID 117159499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).