[1,2]oxazolo[4,3-g]indolizine

C9H6N2O — CID 45099171

IUPAC[1,2]oxazolo[4,3-g]indolizine
SMILESc1cc2c3nocc3ccn2c1
InChIInChI=1S/C9H6N2O/c1-2-8-9-7(6-12-10-9)3-5-11(8)4-1/h1-6H
InChIKeyXBFWHARSGWAPJN-UHFFFAOYSA-N
MW158.16 g/mol
LogP2.08
Rot. Bonds

About [1,2]oxazolo[4,3-g]indolizine

[1,2]oxazolo[4,3-g]indolizine (PubChem CID 45099171) has the molecular formula C9H6N2O and a molecular weight of 158.16 g/mol. Its IUPAC name is [1,2]oxazolo[4,3-g]indolizine.

Molecular Properties

Compound Name[1,2]oxazolo[4,3-g]indolizine
PubChem CID45099171
Molecular FormulaC9H6N2O
Molecular Weight158.16 g/mol
Exact Mass158.05
IUPAC Name[1,2]oxazolo[4,3-g]indolizine
SMILESc1cc2c3nocc3ccn2c1
InChIInChI=1S/C9H6N2O/c1-2-8-9-7(6-12-10-9)3-5-11(8)4-1/h1-6H
InChIKeyXBFWHARSGWAPJN-UHFFFAOYSA-N
XLogP2.08
TPSA30.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.16
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1,2]oxazolo[4,3-g]indolizine?
The IUPAC name of [1,2]oxazolo[4,3-g]indolizine (CID 45099171) is [1,2]oxazolo[4,3-g]indolizine.
What is the SMILES notation for [1,2]oxazolo[4,3-g]indolizine?
The canonical SMILES for [1,2]oxazolo[4,3-g]indolizine is c1cc2c3nocc3ccn2c1.
What is the InChIKey of [1,2]oxazolo[4,3-g]indolizine?
The InChIKey is XBFWHARSGWAPJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6N2O/c1-2-8-9-7(6-12-10-9)3-5-11(8)4-1/h1-6H.
What are the key properties of [1,2]oxazolo[4,3-g]indolizine?
[1,2]oxazolo[4,3-g]indolizine has a molecular weight of 158.16 g/mol, XLogP of 2.08, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1,2]oxazolo[4,3-g]indolizine is sourced from PubChem (CID 45099171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).