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

C10H13N3O2 — CID 117146178

IUPAC3-(3-methoxypropyl)-[1,2,4]triazolo[4,3-a]pyridin-8-ol
SMILESCOCCCc1nnc2c(O)cccn12
InChIInChI=1S/C10H13N3O2/c1-15-7-3-5-9-11-12-10-8(14)4-2-6-13(9)10/h2,4,6,14H,3,5,7H2,1H3
InChIKeyDDYFZKHBNMJFJE-UHFFFAOYSA-N
MW207.23 g/mol
LogP1.01
Rot. Bonds4

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

3-(3-methoxypropyl)-[1,2,4]triazolo[4,3-a]pyridin-8-ol (PubChem CID 117146178) has the molecular formula C10H13N3O2 and a molecular weight of 207.23 g/mol. Its IUPAC name is 3-(3-methoxypropyl)-[1,2,4]triazolo[4,3-a]pyridin-8-ol.

Molecular Properties

Compound Name3-(3-methoxypropyl)-[1,2,4]triazolo[4,3-a]pyridin-8-ol
PubChem CID117146178
Molecular FormulaC10H13N3O2
Molecular Weight207.23 g/mol
Exact Mass207.10
IUPAC Name3-(3-methoxypropyl)-[1,2,4]triazolo[4,3-a]pyridin-8-ol
SMILESCOCCCc1nnc2c(O)cccn12
InChIInChI=1S/C10H13N3O2/c1-15-7-3-5-9-11-12-10-8(14)4-2-6-13(9)10/h2,4,6,14H,3,5,7H2,1H3
InChIKeyDDYFZKHBNMJFJE-UHFFFAOYSA-N
XLogP1.01
TPSA59.65 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 51.01
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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Related Compounds

3-(3-methoxypropyl)-[1,2,4]triazolo[4,3-a]pyridine-8-carbaldehyde
CID 117145916
3-[2-(dimethylamino)ethyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117147323
3-[(4-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117147016
3-[(3-methylphenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117146892
3-[(2-fluorophenyl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117146975
8-hydroxy-3-(2-methoxyethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117252133
8-methyl-3-propyl-[1,2,4]triazolo[4,3-a]pyridine
CID 117147073
3-(bromomethyl)-5-(3-methoxypropyl)-4-methyl-1,2,4-triazole
CID 115399862
3-[(1,1-dioxothian-4-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117146384
8-hydroxy-3-(methoxymethyl)imidazo[1,5-a]pyridine-1-carboxylic acid
CID 117255582
3-[(1-propan-2-ylpiperidin-3-yl)methyl]-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117146785
3-phenyl-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 117147107

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxypropyl)-[1,2,4]triazolo[4,3-a]pyridin-8-ol?
The IUPAC name of 3-(3-methoxypropyl)-[1,2,4]triazolo[4,3-a]pyridin-8-ol (CID 117146178) is 3-(3-methoxypropyl)-[1,2,4]triazolo[4,3-a]pyridin-8-ol.
What is the SMILES notation for 3-(3-methoxypropyl)-[1,2,4]triazolo[4,3-a]pyridin-8-ol?
The canonical SMILES for 3-(3-methoxypropyl)-[1,2,4]triazolo[4,3-a]pyridin-8-ol is COCCCc1nnc2c(O)cccn12.
What is the InChIKey of 3-(3-methoxypropyl)-[1,2,4]triazolo[4,3-a]pyridin-8-ol?
The InChIKey is DDYFZKHBNMJFJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O2/c1-15-7-3-5-9-11-12-10-8(14)4-2-6-13(9)10/h2,4,6,14H,3,5,7H2,1H3.
What are the key properties of 3-(3-methoxypropyl)-[1,2,4]triazolo[4,3-a]pyridin-8-ol?
3-(3-methoxypropyl)-[1,2,4]triazolo[4,3-a]pyridin-8-ol has a molecular weight of 207.23 g/mol, XLogP of 1.01, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxypropyl)-[1,2,4]triazolo[4,3-a]pyridin-8-ol is sourced from PubChem (CID 117146178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).