1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butan-1-amine

C10H14N4 — CID 43630109

IUPAC1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butan-1-amine
SMILESCCCC(N)c1nnc2ccccn12
InChIInChI=1S/C10H14N4/c1-2-5-8(11)10-13-12-9-6-3-4-7-14(9)10/h3-4,6-8H,2,5,11H2,1H3
InChIKeyRBOYUUKZWTVYLX-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.53
Rot. Bonds3

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

1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butan-1-amine (PubChem CID 43630109) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is 1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butan-1-amine.

Molecular Properties

Compound Name1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butan-1-amine
PubChem CID43630109
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butan-1-amine
SMILESCCCC(N)c1nnc2ccccn12
InChIInChI=1S/C10H14N4/c1-2-5-8(11)10-13-12-9-6-3-4-7-14(9)10/h3-4,6-8H,2,5,11H2,1H3
InChIKeyRBOYUUKZWTVYLX-UHFFFAOYSA-N
XLogP1.53
TPSA56.21 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butan-1-amine?
The IUPAC name of 1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butan-1-amine (CID 43630109) is 1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butan-1-amine.
What is the SMILES notation for 1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butan-1-amine?
The canonical SMILES for 1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butan-1-amine is CCCC(N)c1nnc2ccccn12.
What is the InChIKey of 1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butan-1-amine?
The InChIKey is RBOYUUKZWTVYLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-2-5-8(11)10-13-12-9-6-3-4-7-14(9)10/h3-4,6-8H,2,5,11H2,1H3.
What are the key properties of 1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butan-1-amine?
1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butan-1-amine has a molecular weight of 190.25 g/mol, XLogP of 1.53, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-([1,2,4]triazolo[4,3-a]pyridin-3-yl)butan-1-amine is sourced from PubChem (CID 43630109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).