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

C9H11N5 — CID 174145326

IUPAC6-(5-ethyl-1,2,4-triazol-1-yl)pyridin-3-amine
SMILESCCc1ncnn1-c1ccc(N)cn1
InChIInChI=1S/C9H11N5/c1-2-8-12-6-13-14(8)9-4-3-7(10)5-11-9/h3-6H,2,10H2,1H3
InChIKeyKBFZSVFHMOLBOO-UHFFFAOYSA-N
MW189.22 g/mol
LogP0.81
Rot. Bonds2

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

6-(5-ethyl-1,2,4-triazol-1-yl)pyridin-3-amine (PubChem CID 174145326) has the molecular formula C9H11N5 and a molecular weight of 189.22 g/mol. Its IUPAC name is 6-(5-ethyl-1,2,4-triazol-1-yl)pyridin-3-amine.

Molecular Properties

Compound Name6-(5-ethyl-1,2,4-triazol-1-yl)pyridin-3-amine
PubChem CID174145326
Molecular FormulaC9H11N5
Molecular Weight189.22 g/mol
Exact Mass189.10
IUPAC Name6-(5-ethyl-1,2,4-triazol-1-yl)pyridin-3-amine
SMILESCCc1ncnn1-c1ccc(N)cn1
InChIInChI=1S/C9H11N5/c1-2-8-12-6-13-14(8)9-4-3-7(10)5-11-9/h3-6H,2,10H2,1H3
InChIKeyKBFZSVFHMOLBOO-UHFFFAOYSA-N
XLogP0.81
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(5-ethyl-1,2,4-triazol-1-yl)pyridin-3-amine?
The IUPAC name of 6-(5-ethyl-1,2,4-triazol-1-yl)pyridin-3-amine (CID 174145326) is 6-(5-ethyl-1,2,4-triazol-1-yl)pyridin-3-amine.
What is the SMILES notation for 6-(5-ethyl-1,2,4-triazol-1-yl)pyridin-3-amine?
The canonical SMILES for 6-(5-ethyl-1,2,4-triazol-1-yl)pyridin-3-amine is CCc1ncnn1-c1ccc(N)cn1.
What is the InChIKey of 6-(5-ethyl-1,2,4-triazol-1-yl)pyridin-3-amine?
The InChIKey is KBFZSVFHMOLBOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5/c1-2-8-12-6-13-14(8)9-4-3-7(10)5-11-9/h3-6H,2,10H2,1H3.
What are the key properties of 6-(5-ethyl-1,2,4-triazol-1-yl)pyridin-3-amine?
6-(5-ethyl-1,2,4-triazol-1-yl)pyridin-3-amine has a molecular weight of 189.22 g/mol, XLogP of 0.81, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-ethyl-1,2,4-triazol-1-yl)pyridin-3-amine is sourced from PubChem (CID 174145326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).