5-methyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-amine

C11H10N4S — CID 82061325

IUPAC5-methyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-amine
SMILESCc1c(N)ccc2nnc(-c3cccs3)n12
InChIInChI=1S/C11H10N4S/c1-7-8(12)4-5-10-13-14-11(15(7)10)9-3-2-6-16-9/h2-6H,12H2,1H3
InChIKeyJIIPACILLONNRK-UHFFFAOYSA-N
MW230.30 g/mol
LogP2.35
Rot. Bonds1

About 5-methyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-amine

5-methyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-amine (PubChem CID 82061325) has the molecular formula C11H10N4S and a molecular weight of 230.30 g/mol. Its IUPAC name is 5-methyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-amine.

Molecular Properties

Compound Name5-methyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-amine
PubChem CID82061325
Molecular FormulaC11H10N4S
Molecular Weight230.30 g/mol
Exact Mass230.06
IUPAC Name5-methyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-amine
SMILESCc1c(N)ccc2nnc(-c3cccs3)n12
InChIInChI=1S/C11H10N4S/c1-7-8(12)4-5-10-13-14-11(15(7)10)9-3-2-6-16-9/h2-6H,12H2,1H3
InChIKeyJIIPACILLONNRK-UHFFFAOYSA-N
XLogP2.35
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.30
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-3-(thiophen-2-ylmethyl)-[1,2,4]triazolo[4,3-a]pyridin-6-amine
CID 82061343
5-methyl-3-(2-methylphenyl)-[1,2,4]triazolo[4,3-a]pyridin-6-amine
CID 82061327
7-chloro-5-methyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-c]pyrimidine
CID 65426303
3-(3-bromophenyl)-5-methyl-[1,2,4]triazolo[4,3-a]pyridin-6-amine
CID 82061334
methyl 3-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridine-5-carboxylate
CID 117142735
5-methyl-3-propyl-[1,2,4]triazolo[4,3-a]pyridin-6-amine
CID 82061317
(3-thiophen-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)methanamine
CID 90009339
7-methyl-2-thiophen-2-ylimidazo[1,2-a]pyridin-6-amine
CID 82060155
2-thiophen-2-ylbenzene-1,3-diamine
CID 69383856
5-thiophen-2-yl-4-[2-(trifluoromethyl)phenyl]-1,2,4-triazol-3-amine;hydrobromide
CID 134541177
ethane;2-methyl-4-thiophen-2-ylaniline
CID 143928116
methyl (2S)-2-[(3-thiophen-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)sulfanyl]propanoate
CID 7190424

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-amine?
The IUPAC name of 5-methyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-amine (CID 82061325) is 5-methyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-amine.
What is the SMILES notation for 5-methyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-amine?
The canonical SMILES for 5-methyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-amine is Cc1c(N)ccc2nnc(-c3cccs3)n12.
What is the InChIKey of 5-methyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-amine?
The InChIKey is JIIPACILLONNRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4S/c1-7-8(12)4-5-10-13-14-11(15(7)10)9-3-2-6-16-9/h2-6H,12H2,1H3.
What are the key properties of 5-methyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-amine?
5-methyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-amine has a molecular weight of 230.30 g/mol, XLogP of 2.35, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-thiophen-2-yl-[1,2,4]triazolo[4,3-a]pyridin-6-amine is sourced from PubChem (CID 82061325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).