5,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine

C8H11N3 — CID 123757273

IUPAC5,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
SMILESCC1=C(C)n2cnnc2CC1
InChIInChI=1S/C8H11N3/c1-6-3-4-8-10-9-5-11(8)7(6)2/h5H,3-4H2,1-2H3
InChIKeyDEBBIZWPNFVTCW-UHFFFAOYSA-N
MW149.20 g/mol
LogP1.48
Rot. Bonds

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

5,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine (PubChem CID 123757273) has the molecular formula C8H11N3 and a molecular weight of 149.20 g/mol. Its IUPAC name is 5,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine.

Molecular Properties

Compound Name5,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
PubChem CID123757273
Molecular FormulaC8H11N3
Molecular Weight149.20 g/mol
Exact Mass149.10
IUPAC Name5,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
SMILESCC1=C(C)n2cnnc2CC1
InChIInChI=1S/C8H11N3/c1-6-3-4-8-10-9-5-11(8)7(6)2/h5H,3-4H2,1-2H3
InChIKeyDEBBIZWPNFVTCW-UHFFFAOYSA-N
XLogP1.48
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.20
LogP ≤ 51.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-(1-Fluoroethenyl)-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
CID 123363488
5-(1-Fluoroethyl)-3,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
CID 123853050
5-(Fluoromethyl)-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
CID 123905242
8-propan-2-ylidene-6,7-dihydro-5H-[1,2,4]triazolo[4,3-a]pyridine
CID 59299796
5-Ethyl-3,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
CID 123297633
5-(1-Chloroethenyl)-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
CID 123711353
5-Ethenyl-6-methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
CID 123819444
7-Methyl-5,6-dimethylidene-[1,2,4]triazolo[4,3-a]pyridine
CID 143517645
3-(Cyclopenten-1-ylmethyl)-4-methyl-1,2,4-triazole
CID 130987786
4-Methyl-3-(4-methylpent-3-en-1-yl)-4h-1,2,4-triazole
CID 164658335

Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine?
The IUPAC name of 5,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine (CID 123757273) is 5,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine.
What is the SMILES notation for 5,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine?
The canonical SMILES for 5,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine is CC1=C(C)n2cnnc2CC1.
What is the InChIKey of 5,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine?
The InChIKey is DEBBIZWPNFVTCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3/c1-6-3-4-8-10-9-5-11(8)7(6)2/h5H,3-4H2,1-2H3.
What are the key properties of 5,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine?
5,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine has a molecular weight of 149.20 g/mol, XLogP of 1.48, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine is sourced from PubChem (CID 123757273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).