7-methoxy-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine

C7H11N3O — CID 168893978

IUPAC7-methoxy-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
SMILESCOC1CCn2cnnc2C1
InChIInChI=1S/C7H11N3O/c1-11-6-2-3-10-5-8-9-7(10)4-6/h5-6H,2-4H2,1H3
InChIKeyHDOLYSLMLQFPIX-UHFFFAOYSA-N
MW153.19 g/mol
LogP0.24
Rot. Bonds1

About 7-methoxy-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine

7-methoxy-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 168893978) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is 7-methoxy-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name7-methoxy-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID168893978
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC Name7-methoxy-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
SMILESCOC1CCn2cnnc2C1
InChIInChI=1S/C7H11N3O/c1-11-6-2-3-10-5-8-9-7(10)4-6/h5-6H,2-4H2,1H3
InChIKeyHDOLYSLMLQFPIX-UHFFFAOYSA-N
XLogP0.24
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 50.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7-methoxy-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine with MolForge

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Related Compounds

5H,6H,7H,8H-(1,2,4)triazolo(4,3-a)pyridine
CID 20289271
5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyridin-8-ol
CID 54092923
5H,6H,7H,8H-[1,2,4]triazolo[4,3-a]pyridin-6-ol
CID 117148996
(8S)-8-methyl-6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazine
CID 57802971
8-methyl-6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazine
CID 76614913
5,6,7,8-Tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-ol
CID 84648397
3-ethyl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine
CID 89233292
Ethane;5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine
CID 91161806
3-methyl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine
CID 117607496
3,5-dimethyl-7,8-dihydro-5H-[1,2,4]triazolo[4,3-c][1,3]oxazine
CID 130374296
ethene;8-methyl-6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazine
CID 142249214
4-(3-Methoxypropyl)-3-methyl-1,2,4-triazole
CID 143913721

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 7-methoxy-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine (CID 168893978) is 7-methoxy-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 7-methoxy-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 7-methoxy-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine is COC1CCn2cnnc2C1.
What is the InChIKey of 7-methoxy-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is HDOLYSLMLQFPIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-11-6-2-3-10-5-8-9-7(10)4-6/h5-6H,2-4H2,1H3.
What are the key properties of 7-methoxy-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine?
7-methoxy-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 153.19 g/mol, XLogP of 0.24, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 168893978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).