5-propyl-6-(1,2,4-triazol-1-yl)pyridin-3-amine

C10H13N5 — CID 123728648

IUPAC5-propyl-6-(1,2,4-triazol-1-yl)pyridin-3-amine
SMILESCCCc1cc(N)cnc1-n1cncn1
InChIInChI=1S/C10H13N5/c1-2-3-8-4-9(11)5-13-10(8)15-7-12-6-14-15/h4-7H,2-3,11H2,1H3
InChIKeyJBAYTACACKFNLO-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.20
Rot. Bonds3

About 5-propyl-6-(1,2,4-triazol-1-yl)pyridin-3-amine

5-propyl-6-(1,2,4-triazol-1-yl)pyridin-3-amine (PubChem CID 123728648) has the molecular formula C10H13N5 and a molecular weight of 203.25 g/mol. Its IUPAC name is 5-propyl-6-(1,2,4-triazol-1-yl)pyridin-3-amine.

Molecular Properties

Compound Name5-propyl-6-(1,2,4-triazol-1-yl)pyridin-3-amine
PubChem CID123728648
Molecular FormulaC10H13N5
Molecular Weight203.25 g/mol
Exact Mass203.12
IUPAC Name5-propyl-6-(1,2,4-triazol-1-yl)pyridin-3-amine
SMILESCCCc1cc(N)cnc1-n1cncn1
InChIInChI=1S/C10H13N5/c1-2-3-8-4-9(11)5-13-10(8)15-7-12-6-14-15/h4-7H,2-3,11H2,1H3
InChIKeyJBAYTACACKFNLO-UHFFFAOYSA-N
XLogP1.20
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-propyl-6-(1,2,4-triazol-1-yl)pyridin-3-amine?
The IUPAC name of 5-propyl-6-(1,2,4-triazol-1-yl)pyridin-3-amine (CID 123728648) is 5-propyl-6-(1,2,4-triazol-1-yl)pyridin-3-amine.
What is the SMILES notation for 5-propyl-6-(1,2,4-triazol-1-yl)pyridin-3-amine?
The canonical SMILES for 5-propyl-6-(1,2,4-triazol-1-yl)pyridin-3-amine is CCCc1cc(N)cnc1-n1cncn1.
What is the InChIKey of 5-propyl-6-(1,2,4-triazol-1-yl)pyridin-3-amine?
The InChIKey is JBAYTACACKFNLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5/c1-2-3-8-4-9(11)5-13-10(8)15-7-12-6-14-15/h4-7H,2-3,11H2,1H3.
What are the key properties of 5-propyl-6-(1,2,4-triazol-1-yl)pyridin-3-amine?
5-propyl-6-(1,2,4-triazol-1-yl)pyridin-3-amine has a molecular weight of 203.25 g/mol, XLogP of 1.20, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propyl-6-(1,2,4-triazol-1-yl)pyridin-3-amine is sourced from PubChem (CID 123728648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).