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

C16H14N6O2 — CID 139073956

IUPAC3-pyridin-4-yl-1,2-oxazol-5-amine
SMILESNc1cc(-c2ccncc2)no1.Nc1cc(-c2ccncc2)no1
InChIInChI=1S/2C8H7N3O/c2*9-8-5-7(11-12-8)6-1-3-10-4-2-6/h2*1-5H,9H2
InChIKeyNEQQOUJJVCLOJB-UHFFFAOYSA-N
MW322.33 g/mol
LogP2.64
Rot. Bonds2

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

3-pyridin-4-yl-1,2-oxazol-5-amine (PubChem CID 139073956) has the molecular formula C16H14N6O2 and a molecular weight of 322.33 g/mol. Its IUPAC name is 3-pyridin-4-yl-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-pyridin-4-yl-1,2-oxazol-5-amine
PubChem CID139073956
Molecular FormulaC16H14N6O2
Molecular Weight322.33 g/mol
Exact Mass322.12
IUPAC Name3-pyridin-4-yl-1,2-oxazol-5-amine
SMILESNc1cc(-c2ccncc2)no1.Nc1cc(-c2ccncc2)no1
InChIInChI=1S/2C8H7N3O/c2*9-8-5-7(11-12-8)6-1-3-10-4-2-6/h2*1-5H,9H2
InChIKeyNEQQOUJJVCLOJB-UHFFFAOYSA-N
XLogP2.64
TPSA129.88 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.33
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Related Compounds

5-methyl-3-phenyl-N-pyridin-4-yl-1,2-oxazole-4-carboxamide
CID 1122041
3-(Pyridin-4-yl)-1,2-oxazol-5-amine
CID 12717854
4-Methyl-3-(pyridin-2-yl)-1,2-oxazol-5-amine
CID 16079540
3,4-Difluoro-N-[3-(pyridin-3-YL)-1,2-oxazol-5-YL]benzamide
CID 53143042
4-(4-Fluorophenyl)-3-pyridin-4-yl-1,2-oxazol-5-amine
CID 33784113
3-(Dimethylamino)-N-[3-(pyridin-3-YL)-1,2-oxazol-5-YL]benzamide
CID 53143047
N-[3-(2-pyridyl)-5-isoxazolyl]-2-pyridinecarboxamide
CID 53143106
phosphonic acid, (3-(4-pyridinyl)-5-isoxazolyl)-, diammonium salt
CID 3079442
4-Methyl-3-(pyridin-3-yl)-1,2-oxazol-5-amine
CID 33784076
3-(3-Pyridinyl)-5-isoxazolamine
CID 33784094
(3-Methyl-[1,2]oxazolo[5,4-b]pyridin-5-yl)-(2-pyridin-4-ylpyrrolidin-1-yl)methanone
CID 51076263
4-Fluoro-N-[3-(pyridin-3-YL)-1,2-oxazol-5-YL]benzamide
CID 53014054

Frequently Asked Questions

What is the IUPAC name of 3-pyridin-4-yl-1,2-oxazol-5-amine?
The IUPAC name of 3-pyridin-4-yl-1,2-oxazol-5-amine (CID 139073956) is 3-pyridin-4-yl-1,2-oxazol-5-amine.
What is the SMILES notation for 3-pyridin-4-yl-1,2-oxazol-5-amine?
The canonical SMILES for 3-pyridin-4-yl-1,2-oxazol-5-amine is Nc1cc(-c2ccncc2)no1.Nc1cc(-c2ccncc2)no1.
What is the InChIKey of 3-pyridin-4-yl-1,2-oxazol-5-amine?
The InChIKey is NEQQOUJJVCLOJB-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H7N3O/c2*9-8-5-7(11-12-8)6-1-3-10-4-2-6/h2*1-5H,9H2.
What are the key properties of 3-pyridin-4-yl-1,2-oxazol-5-amine?
3-pyridin-4-yl-1,2-oxazol-5-amine has a molecular weight of 322.33 g/mol, XLogP of 2.64, 2 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyridin-4-yl-1,2-oxazol-5-amine is sourced from PubChem (CID 139073956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).