4-pyridin-3-yl-1,2-oxazol-5-amine

C8H7N3O — CID 16740669

IUPAC4-pyridin-3-yl-1,2-oxazol-5-amine
SMILESNc1oncc1-c1cccnc1
InChIInChI=1S/C8H7N3O/c9-8-7(5-11-12-8)6-2-1-3-10-4-6/h1-5H,9H2
InChIKeyCZAQWMTZPBTIEZ-UHFFFAOYSA-N
MW161.16 g/mol
LogP1.32
Rot. Bonds1

About 4-pyridin-3-yl-1,2-oxazol-5-amine

4-pyridin-3-yl-1,2-oxazol-5-amine (PubChem CID 16740669) has the molecular formula C8H7N3O and a molecular weight of 161.16 g/mol. Its IUPAC name is 4-pyridin-3-yl-1,2-oxazol-5-amine.

Molecular Properties

Compound Name4-pyridin-3-yl-1,2-oxazol-5-amine
PubChem CID16740669
Molecular FormulaC8H7N3O
Molecular Weight161.16 g/mol
Exact Mass161.06
IUPAC Name4-pyridin-3-yl-1,2-oxazol-5-amine
SMILESNc1oncc1-c1cccnc1
InChIInChI=1S/C8H7N3O/c9-8-7(5-11-12-8)6-2-1-3-10-4-6/h1-5H,9H2
InChIKeyCZAQWMTZPBTIEZ-UHFFFAOYSA-N
XLogP1.32
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.16
LogP ≤ 51.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-pyridin-3-yl-1,2-oxazol-5-amine?
The IUPAC name of 4-pyridin-3-yl-1,2-oxazol-5-amine (CID 16740669) is 4-pyridin-3-yl-1,2-oxazol-5-amine.
What is the SMILES notation for 4-pyridin-3-yl-1,2-oxazol-5-amine?
The canonical SMILES for 4-pyridin-3-yl-1,2-oxazol-5-amine is Nc1oncc1-c1cccnc1.
What is the InChIKey of 4-pyridin-3-yl-1,2-oxazol-5-amine?
The InChIKey is CZAQWMTZPBTIEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3O/c9-8-7(5-11-12-8)6-2-1-3-10-4-6/h1-5H,9H2.
What are the key properties of 4-pyridin-3-yl-1,2-oxazol-5-amine?
4-pyridin-3-yl-1,2-oxazol-5-amine has a molecular weight of 161.16 g/mol, XLogP of 1.32, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyridin-3-yl-1,2-oxazol-5-amine is sourced from PubChem (CID 16740669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).