2-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-1-amine

C11H16N4 — CID 83882085

IUPAC2-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-1-amine
SMILESCCc1nnc2c(C(C)CN)cccn12
InChIInChI=1S/C11H16N4/c1-3-10-13-14-11-9(8(2)7-12)5-4-6-15(10)11/h4-6,8H,3,7,12H2,1-2H3
InChIKeyQTEZSPQJKQPNCA-UHFFFAOYSA-N
MW204.28 g/mol
LogP1.35
Rot. Bonds3

About 2-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-1-amine

2-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-1-amine (PubChem CID 83882085) has the molecular formula C11H16N4 and a molecular weight of 204.28 g/mol. Its IUPAC name is 2-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-1-amine.

Molecular Properties

Compound Name2-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-1-amine
PubChem CID83882085
Molecular FormulaC11H16N4
Molecular Weight204.28 g/mol
Exact Mass204.14
IUPAC Name2-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-1-amine
SMILESCCc1nnc2c(C(C)CN)cccn12
InChIInChI=1S/C11H16N4/c1-3-10-13-14-11-9(8(2)7-12)5-4-6-15(10)11/h4-6,8H,3,7,12H2,1-2H3
InChIKeyQTEZSPQJKQPNCA-UHFFFAOYSA-N
XLogP1.35
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.28
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-1-amine?
The IUPAC name of 2-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-1-amine (CID 83882085) is 2-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-1-amine.
What is the SMILES notation for 2-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-1-amine?
The canonical SMILES for 2-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-1-amine is CCc1nnc2c(C(C)CN)cccn12.
What is the InChIKey of 2-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-1-amine?
The InChIKey is QTEZSPQJKQPNCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4/c1-3-10-13-14-11-9(8(2)7-12)5-4-6-15(10)11/h4-6,8H,3,7,12H2,1-2H3.
What are the key properties of 2-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-1-amine?
2-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-1-amine has a molecular weight of 204.28 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethyl-[1,2,4]triazolo[4,3-a]pyridin-8-yl)propan-1-amine is sourced from PubChem (CID 83882085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).