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

C10H11N3O — CID 80523163

IUPAC3-ethyl-4-pyridin-3-yl-1,2-oxazol-5-amine
SMILESCCc1noc(N)c1-c1cccnc1
InChIInChI=1S/C10H11N3O/c1-2-8-9(10(11)14-13-8)7-4-3-5-12-6-7/h3-6H,2,11H2,1H3
InChIKeyDWMKQFIRRXHLRZ-UHFFFAOYSA-N
MW189.22 g/mol
LogP1.88
Rot. Bonds2

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

3-ethyl-4-pyridin-3-yl-1,2-oxazol-5-amine (PubChem CID 80523163) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 3-ethyl-4-pyridin-3-yl-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-ethyl-4-pyridin-3-yl-1,2-oxazol-5-amine
PubChem CID80523163
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name3-ethyl-4-pyridin-3-yl-1,2-oxazol-5-amine
SMILESCCc1noc(N)c1-c1cccnc1
InChIInChI=1S/C10H11N3O/c1-2-8-9(10(11)14-13-8)7-4-3-5-12-6-7/h3-6H,2,11H2,1H3
InChIKeyDWMKQFIRRXHLRZ-UHFFFAOYSA-N
XLogP1.88
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4-pyridin-3-yl-1,2-oxazol-5-amine?
The IUPAC name of 3-ethyl-4-pyridin-3-yl-1,2-oxazol-5-amine (CID 80523163) is 3-ethyl-4-pyridin-3-yl-1,2-oxazol-5-amine.
What is the SMILES notation for 3-ethyl-4-pyridin-3-yl-1,2-oxazol-5-amine?
The canonical SMILES for 3-ethyl-4-pyridin-3-yl-1,2-oxazol-5-amine is CCc1noc(N)c1-c1cccnc1.
What is the InChIKey of 3-ethyl-4-pyridin-3-yl-1,2-oxazol-5-amine?
The InChIKey is DWMKQFIRRXHLRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c1-2-8-9(10(11)14-13-8)7-4-3-5-12-6-7/h3-6H,2,11H2,1H3.
What are the key properties of 3-ethyl-4-pyridin-3-yl-1,2-oxazol-5-amine?
3-ethyl-4-pyridin-3-yl-1,2-oxazol-5-amine has a molecular weight of 189.22 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4-pyridin-3-yl-1,2-oxazol-5-amine is sourced from PubChem (CID 80523163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).