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

C11H13N5O — CID 43261860

IUPAC2-(cyclopropylmethoxy)-6-(1,2,4-triazol-1-yl)pyridin-3-amine
SMILESNc1ccc(-n2cncn2)nc1OCC1CC1
InChIInChI=1S/C11H13N5O/c12-9-3-4-10(16-7-13-6-14-16)15-11(9)17-5-8-1-2-8/h3-4,6-8H,1-2,5,12H2
InChIKeyJSXGCZKYOFFEIM-UHFFFAOYSA-N
MW231.26 g/mol
LogP1.03
Rot. Bonds4

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

2-(cyclopropylmethoxy)-6-(1,2,4-triazol-1-yl)pyridin-3-amine (PubChem CID 43261860) has the molecular formula C11H13N5O and a molecular weight of 231.26 g/mol. Its IUPAC name is 2-(cyclopropylmethoxy)-6-(1,2,4-triazol-1-yl)pyridin-3-amine.

Molecular Properties

Compound Name2-(cyclopropylmethoxy)-6-(1,2,4-triazol-1-yl)pyridin-3-amine
PubChem CID43261860
Molecular FormulaC11H13N5O
Molecular Weight231.26 g/mol
Exact Mass231.11
IUPAC Name2-(cyclopropylmethoxy)-6-(1,2,4-triazol-1-yl)pyridin-3-amine
SMILESNc1ccc(-n2cncn2)nc1OCC1CC1
InChIInChI=1S/C11H13N5O/c12-9-3-4-10(16-7-13-6-14-16)15-11(9)17-5-8-1-2-8/h3-4,6-8H,1-2,5,12H2
InChIKeyJSXGCZKYOFFEIM-UHFFFAOYSA-N
XLogP1.03
TPSA78.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.26
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(cyclopropylmethoxy)-6-(1,2,4-triazol-1-yl)pyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethoxy)-6-(1,2,4-triazol-1-yl)pyridin-3-amine?
The IUPAC name of 2-(cyclopropylmethoxy)-6-(1,2,4-triazol-1-yl)pyridin-3-amine (CID 43261860) is 2-(cyclopropylmethoxy)-6-(1,2,4-triazol-1-yl)pyridin-3-amine.
What is the SMILES notation for 2-(cyclopropylmethoxy)-6-(1,2,4-triazol-1-yl)pyridin-3-amine?
The canonical SMILES for 2-(cyclopropylmethoxy)-6-(1,2,4-triazol-1-yl)pyridin-3-amine is Nc1ccc(-n2cncn2)nc1OCC1CC1.
What is the InChIKey of 2-(cyclopropylmethoxy)-6-(1,2,4-triazol-1-yl)pyridin-3-amine?
The InChIKey is JSXGCZKYOFFEIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O/c12-9-3-4-10(16-7-13-6-14-16)15-11(9)17-5-8-1-2-8/h3-4,6-8H,1-2,5,12H2.
What are the key properties of 2-(cyclopropylmethoxy)-6-(1,2,4-triazol-1-yl)pyridin-3-amine?
2-(cyclopropylmethoxy)-6-(1,2,4-triazol-1-yl)pyridin-3-amine has a molecular weight of 231.26 g/mol, XLogP of 1.03, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethoxy)-6-(1,2,4-triazol-1-yl)pyridin-3-amine is sourced from PubChem (CID 43261860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).