3-methoxy-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine

C8H11N3O — CID 142345293

IUPAC3-methoxy-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
SMILESCOc1nnc2n1C=C(C)CC2
InChIInChI=1S/C8H11N3O/c1-6-3-4-7-9-10-8(12-2)11(7)5-6/h5H,3-4H2,1-2H3
InChIKeyDFRVFKCTLDKIOP-UHFFFAOYSA-N
MW165.20 g/mol
LogP1.09
Rot. Bonds1

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

3-methoxy-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 142345293) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is 3-methoxy-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name3-methoxy-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID142345293
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC Name3-methoxy-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
SMILESCOc1nnc2n1C=C(C)CC2
InChIInChI=1S/C8H11N3O/c1-6-3-4-7-9-10-8(12-2)11(7)5-6/h5H,3-4H2,1-2H3
InChIKeyDFRVFKCTLDKIOP-UHFFFAOYSA-N
XLogP1.09
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 51.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-Propan-2-yl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
CID 140925383
3,6-Dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine;ethane
CID 142345245
Ethane;3-methoxy-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
CID 142345292
Ethane;3-ethyl-5-methoxy-4-(2-methylprop-1-enyl)-1,2,4-triazole
CID 142345415
Ethane;6-methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine
CID 143587981
6-Methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine
CID 143587982
6-Ethyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine
CID 148069634
Ethane;6-propan-2-yl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
CID 164555160
6-Propan-2-yl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
CID 164555161
3-methyl-7-methylidene-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyridine
CID 168957890
3,6-Dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
CID 142345246
3-Ethyl-5-methoxy-4-(2-methylprop-1-enyl)-1,2,4-triazole
CID 142345416

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 3-methoxy-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine (CID 142345293) is 3-methoxy-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 3-methoxy-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 3-methoxy-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine is COc1nnc2n1C=C(C)CC2.
What is the InChIKey of 3-methoxy-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is DFRVFKCTLDKIOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c1-6-3-4-7-9-10-8(12-2)11(7)5-6/h5H,3-4H2,1-2H3.
What are the key properties of 3-methoxy-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine?
3-methoxy-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 165.20 g/mol, XLogP of 1.09, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 142345293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).