2-(1-ethylpyrrolidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-amine

C12H17N5 — CID 117134200

IUPAC2-(1-ethylpyrrolidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-amine
SMILESCCN1CCCC1c1nc2cc(N)ccn2n1
InChIInChI=1S/C12H17N5/c1-2-16-6-3-4-10(16)12-14-11-8-9(13)5-7-17(11)15-12/h5,7-8,10H,2-4,6,13H2,1H3
InChIKeyQQPJDVRWQONKBV-UHFFFAOYSA-N
MW231.30 g/mol
LogP1.47
Rot. Bonds2

About 2-(1-ethylpyrrolidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-amine

2-(1-ethylpyrrolidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-amine (PubChem CID 117134200) has the molecular formula C12H17N5 and a molecular weight of 231.30 g/mol. Its IUPAC name is 2-(1-ethylpyrrolidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-amine.

Molecular Properties

Compound Name2-(1-ethylpyrrolidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-amine
PubChem CID117134200
Molecular FormulaC12H17N5
Molecular Weight231.30 g/mol
Exact Mass231.15
IUPAC Name2-(1-ethylpyrrolidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-amine
SMILESCCN1CCCC1c1nc2cc(N)ccn2n1
InChIInChI=1S/C12H17N5/c1-2-16-6-3-4-10(16)12-14-11-8-9(13)5-7-17(11)15-12/h5,7-8,10H,2-4,6,13H2,1H3
InChIKeyQQPJDVRWQONKBV-UHFFFAOYSA-N
XLogP1.47
TPSA59.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(1-ethylpyrrolidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-amine?
The IUPAC name of 2-(1-ethylpyrrolidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-amine (CID 117134200) is 2-(1-ethylpyrrolidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-amine.
What is the SMILES notation for 2-(1-ethylpyrrolidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-amine?
The canonical SMILES for 2-(1-ethylpyrrolidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-amine is CCN1CCCC1c1nc2cc(N)ccn2n1.
What is the InChIKey of 2-(1-ethylpyrrolidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-amine?
The InChIKey is QQPJDVRWQONKBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N5/c1-2-16-6-3-4-10(16)12-14-11-8-9(13)5-7-17(11)15-12/h5,7-8,10H,2-4,6,13H2,1H3.
What are the key properties of 2-(1-ethylpyrrolidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-amine?
2-(1-ethylpyrrolidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-amine has a molecular weight of 231.30 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-ethylpyrrolidin-2-yl)-[1,2,4]triazolo[1,5-a]pyridin-7-amine is sourced from PubChem (CID 117134200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).