9H-carbazole;3H-1,3-oxazol-2-one

C15H12N2O2 — CID 159726894

IUPAC9H-carbazole;3H-1,3-oxazol-2-one
SMILESO=c1[nH]cco1.c1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C12H9N.C3H3NO2/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;5-3-4-1-2-6-3/h1-8,13H;1-2H,(H,4,5)
InChIKeyNATDAVGTSQQINO-UHFFFAOYSA-N
MW252.27 g/mol
LogP3.29
Rot. Bonds

About 9H-carbazole;3H-1,3-oxazol-2-one

9H-carbazole;3H-1,3-oxazol-2-one (PubChem CID 159726894) has the molecular formula C15H12N2O2 and a molecular weight of 252.27 g/mol. Its IUPAC name is 9H-carbazole;3H-1,3-oxazol-2-one.

Molecular Properties

Compound Name9H-carbazole;3H-1,3-oxazol-2-one
PubChem CID159726894
Molecular FormulaC15H12N2O2
Molecular Weight252.27 g/mol
Exact Mass252.09
IUPAC Name9H-carbazole;3H-1,3-oxazol-2-one
SMILESO=c1[nH]cco1.c1ccc2c(c1)[nH]c1ccccc12
InChIInChI=1S/C12H9N.C3H3NO2/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;5-3-4-1-2-6-3/h1-8,13H;1-2H,(H,4,5)
InChIKeyNATDAVGTSQQINO-UHFFFAOYSA-N
XLogP3.29
TPSA61.79 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 9H-carbazole;3H-1,3-oxazol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 9H-carbazole;3H-1,3-oxazol-2-one?
The IUPAC name of 9H-carbazole;3H-1,3-oxazol-2-one (CID 159726894) is 9H-carbazole;3H-1,3-oxazol-2-one.
What is the SMILES notation for 9H-carbazole;3H-1,3-oxazol-2-one?
The canonical SMILES for 9H-carbazole;3H-1,3-oxazol-2-one is O=c1[nH]cco1.c1ccc2c(c1)[nH]c1ccccc12.
What is the InChIKey of 9H-carbazole;3H-1,3-oxazol-2-one?
The InChIKey is NATDAVGTSQQINO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9N.C3H3NO2/c1-3-7-11-9(5-1)10-6-2-4-8-12(10)13-11;5-3-4-1-2-6-3/h1-8,13H;1-2H,(H,4,5).
What are the key properties of 9H-carbazole;3H-1,3-oxazol-2-one?
9H-carbazole;3H-1,3-oxazol-2-one has a molecular weight of 252.27 g/mol, XLogP of 3.29, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-carbazole;3H-1,3-oxazol-2-one is sourced from PubChem (CID 159726894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).