5-methoxy-6-(triazol-1-yl)pyridin-3-amine

C8H9N5O — CID 133056627

IUPAC5-methoxy-6-(triazol-1-yl)pyridin-3-amine
SMILESCOc1cc(N)cnc1-n1ccnn1
InChIInChI=1S/C8H9N5O/c1-14-7-4-6(9)5-10-8(7)13-3-2-11-12-13/h2-5H,9H2,1H3
InChIKeyDRKOZRCACBGSSC-UHFFFAOYSA-N
MW191.19 g/mol
LogP0.25
Rot. Bonds2

About 5-methoxy-6-(triazol-1-yl)pyridin-3-amine

5-methoxy-6-(triazol-1-yl)pyridin-3-amine (PubChem CID 133056627) has the molecular formula C8H9N5O and a molecular weight of 191.19 g/mol. Its IUPAC name is 5-methoxy-6-(triazol-1-yl)pyridin-3-amine.

Molecular Properties

Compound Name5-methoxy-6-(triazol-1-yl)pyridin-3-amine
PubChem CID133056627
Molecular FormulaC8H9N5O
Molecular Weight191.19 g/mol
Exact Mass191.08
IUPAC Name5-methoxy-6-(triazol-1-yl)pyridin-3-amine
SMILESCOc1cc(N)cnc1-n1ccnn1
InChIInChI=1S/C8H9N5O/c1-14-7-4-6(9)5-10-8(7)13-3-2-11-12-13/h2-5H,9H2,1H3
InChIKeyDRKOZRCACBGSSC-UHFFFAOYSA-N
XLogP0.25
TPSA78.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-6-(triazol-1-yl)pyridin-3-amine?
The IUPAC name of 5-methoxy-6-(triazol-1-yl)pyridin-3-amine (CID 133056627) is 5-methoxy-6-(triazol-1-yl)pyridin-3-amine.
What is the SMILES notation for 5-methoxy-6-(triazol-1-yl)pyridin-3-amine?
The canonical SMILES for 5-methoxy-6-(triazol-1-yl)pyridin-3-amine is COc1cc(N)cnc1-n1ccnn1.
What is the InChIKey of 5-methoxy-6-(triazol-1-yl)pyridin-3-amine?
The InChIKey is DRKOZRCACBGSSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5O/c1-14-7-4-6(9)5-10-8(7)13-3-2-11-12-13/h2-5H,9H2,1H3.
What are the key properties of 5-methoxy-6-(triazol-1-yl)pyridin-3-amine?
5-methoxy-6-(triazol-1-yl)pyridin-3-amine has a molecular weight of 191.19 g/mol, XLogP of 0.25, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-6-(triazol-1-yl)pyridin-3-amine is sourced from PubChem (CID 133056627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).