ethane;6-methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine

C9H15N3 — CID 143587981

IUPACethane;6-methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine
SMILESCC.CC1=Cn2ncnc2CC1
InChIInChI=1S/C7H9N3.C2H6/c1-6-2-3-7-8-5-9-10(7)4-6;1-2/h4-5H,2-3H2,1H3;1-2H3
InChIKeyCPRSBUZCVAZRPT-UHFFFAOYSA-N
MW165.24 g/mol
LogP2.11
Rot. Bonds

About ethane;6-methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine

ethane;6-methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 143587981) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is ethane;6-methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Nameethane;6-methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID143587981
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Nameethane;6-methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine
SMILESCC.CC1=Cn2ncnc2CC1
InChIInChI=1S/C7H9N3.C2H6/c1-6-2-3-7-8-5-9-10(7)4-6;1-2/h4-5H,2-3H2,1H3;1-2H3
InChIKeyCPRSBUZCVAZRPT-UHFFFAOYSA-N
XLogP2.11
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3-Methyl-1-(2-methylprop-1-enyl)-1,2,4-triazole
CID 58503812
2-Methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine
CID 68072983
8-methylidene-6,7-dihydro-5H-[1,2,4]triazolo[1,5-a]pyridine
CID 68285130
2,8-Dimethyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine
CID 89603927
6,8,8-Trimethyl-7,9-dihydro-[1,2,4]triazolo[4,3-a]azepine
CID 91340879
7,8-Dihydro-[1,2,4]triazolo[1,5-a]pyridine
CID 117906456
7,7-dimethyl-8H-[1,2,4]triazolo[1,5-a]pyridine
CID 118030086
7-Methyl-7,8-dihydro-[1,2,4]triazolo[4,3-a]pyridine
CID 123806825
3,4-Dimethylidene-5-(2-methyl-1,2,4-triazol-3-yl)pyridin-2-amine
CID 123878120
1-(2-Ethylbuta-1,3-dienyl)-5-propyl-1,2,4-triazole
CID 123994001
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

Frequently Asked Questions

What is the IUPAC name of ethane;6-methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of ethane;6-methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine (CID 143587981) is ethane;6-methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for ethane;6-methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for ethane;6-methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine is CC.CC1=Cn2ncnc2CC1.
What is the InChIKey of ethane;6-methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is CPRSBUZCVAZRPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3.C2H6/c1-6-2-3-7-8-5-9-10(7)4-6;1-2/h4-5H,2-3H2,1H3;1-2H3.
What are the key properties of ethane;6-methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine?
ethane;6-methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 165.24 g/mol, XLogP of 2.11, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-methyl-7,8-dihydro-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 143587981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).