5-(2-methoxy-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C12H11N5O — CID 141394397

IUPAC5-(2-methoxy-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCOc1cc(-c2cccc3nc(N)nn23)ccn1
InChIInChI=1S/C12H11N5O/c1-18-11-7-8(5-6-14-11)9-3-2-4-10-15-12(13)16-17(9)10/h2-7H,1H3,(H2,13,16)
InChIKeyDGJIVHOHHAADKY-UHFFFAOYSA-N
MW241.25 g/mol
LogP1.38
Rot. Bonds2

About 5-(2-methoxy-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine

5-(2-methoxy-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 141394397) has the molecular formula C12H11N5O and a molecular weight of 241.25 g/mol. Its IUPAC name is 5-(2-methoxy-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound Name5-(2-methoxy-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID141394397
Molecular FormulaC12H11N5O
Molecular Weight241.25 g/mol
Exact Mass241.10
IUPAC Name5-(2-methoxy-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCOc1cc(-c2cccc3nc(N)nn23)ccn1
InChIInChI=1S/C12H11N5O/c1-18-11-7-8(5-6-14-11)9-3-2-4-10-15-12(13)16-17(9)10/h2-7H,1H3,(H2,13,16)
InChIKeyDGJIVHOHHAADKY-UHFFFAOYSA-N
XLogP1.38
TPSA78.33 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxy-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of 5-(2-methoxy-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 141394397) is 5-(2-methoxy-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for 5-(2-methoxy-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for 5-(2-methoxy-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine is COc1cc(-c2cccc3nc(N)nn23)ccn1.
What is the InChIKey of 5-(2-methoxy-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is DGJIVHOHHAADKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N5O/c1-18-11-7-8(5-6-14-11)9-3-2-4-10-15-12(13)16-17(9)10/h2-7H,1H3,(H2,13,16).
What are the key properties of 5-(2-methoxy-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
5-(2-methoxy-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 241.25 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxy-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 141394397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).