2-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)ethanamine

C8H14N4 — CID 84652493

IUPAC2-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)ethanamine
SMILESNCCc1nnn2c1CCCC2
InChIInChI=1S/C8H14N4/c9-5-4-7-8-3-1-2-6-12(8)11-10-7/h1-6,9H2
InChIKeyFQQIYFQTTMBFAR-UHFFFAOYSA-N
MW166.23 g/mol
LogP0.12
Rot. Bonds2

About 2-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)ethanamine

2-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)ethanamine (PubChem CID 84652493) has the molecular formula C8H14N4 and a molecular weight of 166.23 g/mol. Its IUPAC name is 2-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)ethanamine.

Molecular Properties

Compound Name2-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)ethanamine
PubChem CID84652493
Molecular FormulaC8H14N4
Molecular Weight166.23 g/mol
Exact Mass166.12
IUPAC Name2-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)ethanamine
SMILESNCCc1nnn2c1CCCC2
InChIInChI=1S/C8H14N4/c9-5-4-7-8-3-1-2-6-12(8)11-10-7/h1-6,9H2
InChIKeyFQQIYFQTTMBFAR-UHFFFAOYSA-N
XLogP0.12
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.23
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)ethyl]cyclopropan-1-amine
CID 105459565
4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-ylmethanesulfonyl chloride
CID 84699118
1-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)cyclopropan-1-amine
CID 84767683
2-(3-phenyl-5,6,7,8-tetrahydroimidazo[1,5-a]pyridin-1-yl)ethanamine
CID 83648755
3-amino-3-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)propanoic acid
CID 84677663
2-(5-cyclobutyl-1-methyltriazol-4-yl)ethanamine
CID 164663726
3-pyrrolidin-3-yl-4,5,6,7-tetrahydrotriazolo[1,5-a]pyridine
CID 84664289
3-bromo-2-(chloromethyl)-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 68790004
2-(2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-3-yl)ethanamine
CID 83637215
3-(5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)propan-1-amine
CID 47003546
cyclopentane;6,7,8,9-tetrahydro-5H-tetrazolo[1,5-a]azepine
CID 67938725
4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-ylmethanamine
CID 53397595

Frequently Asked Questions

What is the IUPAC name of 2-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)ethanamine?
The IUPAC name of 2-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)ethanamine (CID 84652493) is 2-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)ethanamine.
What is the SMILES notation for 2-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)ethanamine?
The canonical SMILES for 2-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)ethanamine is NCCc1nnn2c1CCCC2.
What is the InChIKey of 2-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)ethanamine?
The InChIKey is FQQIYFQTTMBFAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4/c9-5-4-7-8-3-1-2-6-12(8)11-10-7/h1-6,9H2.
What are the key properties of 2-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)ethanamine?
2-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)ethanamine has a molecular weight of 166.23 g/mol, XLogP of 0.12, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyridin-3-yl)ethanamine is sourced from PubChem (CID 84652493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).