2-(3-methoxypropyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine

C10H14N4O — CID 117135717

IUPAC2-(3-methoxypropyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
SMILESCOCCCc1nc2c(N)cccn2n1
InChIInChI=1S/C10H14N4O/c1-15-7-3-5-9-12-10-8(11)4-2-6-14(10)13-9/h2,4,6H,3,5,7,11H2,1H3
InChIKeyDMQFWKQASHJJRI-UHFFFAOYSA-N
MW206.25 g/mol
LogP0.89
Rot. Bonds4

About 2-(3-methoxypropyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine

2-(3-methoxypropyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine (PubChem CID 117135717) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is 2-(3-methoxypropyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine.

Molecular Properties

Compound Name2-(3-methoxypropyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
PubChem CID117135717
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Name2-(3-methoxypropyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine
SMILESCOCCCc1nc2c(N)cccn2n1
InChIInChI=1S/C10H14N4O/c1-15-7-3-5-9-12-10-8(11)4-2-6-14(10)13-9/h2,4,6H,3,5,7,11H2,1H3
InChIKeyDMQFWKQASHJJRI-UHFFFAOYSA-N
XLogP0.89
TPSA65.44 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxypropyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The IUPAC name of 2-(3-methoxypropyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine (CID 117135717) is 2-(3-methoxypropyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine.
What is the SMILES notation for 2-(3-methoxypropyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The canonical SMILES for 2-(3-methoxypropyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine is COCCCc1nc2c(N)cccn2n1.
What is the InChIKey of 2-(3-methoxypropyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
The InChIKey is DMQFWKQASHJJRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c1-15-7-3-5-9-12-10-8(11)4-2-6-14(10)13-9/h2,4,6H,3,5,7,11H2,1H3.
What are the key properties of 2-(3-methoxypropyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine?
2-(3-methoxypropyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine has a molecular weight of 206.25 g/mol, XLogP of 0.89, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxypropyl)-[1,2,4]triazolo[1,5-a]pyridin-8-amine is sourced from PubChem (CID 117135717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).