7-methoxy-3-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridine

C11H15N3O — CID 117143112

IUPAC7-methoxy-3-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESCOc1ccn2c(CC(C)C)nnc2c1
InChIInChI=1S/C11H15N3O/c1-8(2)6-10-12-13-11-7-9(15-3)4-5-14(10)11/h4-5,7-8H,6H2,1-3H3
InChIKeyTWTJDPOYFJDWLT-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.94
Rot. Bonds3

About 7-methoxy-3-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridine

7-methoxy-3-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 117143112) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 7-methoxy-3-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name7-methoxy-3-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID117143112
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name7-methoxy-3-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridine
SMILESCOc1ccn2c(CC(C)C)nnc2c1
InChIInChI=1S/C11H15N3O/c1-8(2)6-10-12-13-11-7-9(15-3)4-5-14(10)11/h4-5,7-8H,6H2,1-3H3
InChIKeyTWTJDPOYFJDWLT-UHFFFAOYSA-N
XLogP1.94
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(7-methoxy-[1,2,4]triazolo[4,3-a]pyridin-3-yl)acetic acid
CID 105459905
7-methoxy-3-(2-pyrrolidin-1-ylethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117143174
7-methoxy-3-[[2-(trifluoromethyl)phenyl]methyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 117143079
7-methoxy-3-[(1-methylpiperidin-3-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 117143037
7-methoxy-[1,2,4]triazolo[4,3-a]pyridine-3-carbaldehyde
CID 105436739
1-(7-methoxyimidazo[1,2-a]pyridin-3-yl)propan-2-amine
CID 168943587
7-methoxy-3-(1-propan-2-ylpiperidin-4-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117142935
3-(chloromethyl)-4-(3-methoxyphenyl)-5-(2-methylpropyl)-1,2,4-triazole
CID 83968081
7-methoxy-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117143138
3-(4-fluorophenyl)-7-methoxy-[1,2,4]triazolo[4,3-a]pyridine
CID 117143156
3-[(3-methoxyphenoxy)methyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 117257007
7-methoxy-3-(thiolan-3-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117142917

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-3-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 7-methoxy-3-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridine (CID 117143112) is 7-methoxy-3-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 7-methoxy-3-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 7-methoxy-3-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridine is COc1ccn2c(CC(C)C)nnc2c1.
What is the InChIKey of 7-methoxy-3-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is TWTJDPOYFJDWLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-8(2)6-10-12-13-11-7-9(15-3)4-5-14(10)11/h4-5,7-8H,6H2,1-3H3.
What are the key properties of 7-methoxy-3-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridine?
7-methoxy-3-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 205.26 g/mol, XLogP of 1.94, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-3-(2-methylpropyl)-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 117143112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).