3-ethyl-5-(3H-imidazo[4,5-c]quinolin-2-yl)-1,2-oxazole

C15H12N4O — CID 135417231

IUPAC3-ethyl-5-(3H-imidazo[4,5-c]quinolin-2-yl)-1,2-oxazole
SMILESCCc1cc(-c2nc3c(cnc4ccccc43)[nH]2)on1
InChIInChI=1S/C15H12N4O/c1-2-9-7-13(20-19-9)15-17-12-8-16-11-6-4-3-5-10(11)14(12)18-15/h3-8H,2H2,1H3,(H,17,18)
InChIKeyAUIBRGCTYOLDPI-UHFFFAOYSA-N
MW264.29 g/mol
LogP3.33
Rot. Bonds2

About 3-ethyl-5-(3H-imidazo[4,5-c]quinolin-2-yl)-1,2-oxazole

3-ethyl-5-(3H-imidazo[4,5-c]quinolin-2-yl)-1,2-oxazole (PubChem CID 135417231) has the molecular formula C15H12N4O and a molecular weight of 264.29 g/mol. Its IUPAC name is 3-ethyl-5-(3H-imidazo[4,5-c]quinolin-2-yl)-1,2-oxazole.

Molecular Properties

Compound Name3-ethyl-5-(3H-imidazo[4,5-c]quinolin-2-yl)-1,2-oxazole
PubChem CID135417231
Molecular FormulaC15H12N4O
Molecular Weight264.29 g/mol
Exact Mass264.10
IUPAC Name3-ethyl-5-(3H-imidazo[4,5-c]quinolin-2-yl)-1,2-oxazole
SMILESCCc1cc(-c2nc3c(cnc4ccccc43)[nH]2)on1
InChIInChI=1S/C15H12N4O/c1-2-9-7-13(20-19-9)15-17-12-8-16-11-6-4-3-5-10(11)14(12)18-15/h3-8H,2H2,1H3,(H,17,18)
InChIKeyAUIBRGCTYOLDPI-UHFFFAOYSA-N
XLogP3.33
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-(3H-imidazo[4,5-c]quinolin-2-yl)-1,2-oxazole?
The IUPAC name of 3-ethyl-5-(3H-imidazo[4,5-c]quinolin-2-yl)-1,2-oxazole (CID 135417231) is 3-ethyl-5-(3H-imidazo[4,5-c]quinolin-2-yl)-1,2-oxazole.
What is the SMILES notation for 3-ethyl-5-(3H-imidazo[4,5-c]quinolin-2-yl)-1,2-oxazole?
The canonical SMILES for 3-ethyl-5-(3H-imidazo[4,5-c]quinolin-2-yl)-1,2-oxazole is CCc1cc(-c2nc3c(cnc4ccccc43)[nH]2)on1.
What is the InChIKey of 3-ethyl-5-(3H-imidazo[4,5-c]quinolin-2-yl)-1,2-oxazole?
The InChIKey is AUIBRGCTYOLDPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4O/c1-2-9-7-13(20-19-9)15-17-12-8-16-11-6-4-3-5-10(11)14(12)18-15/h3-8H,2H2,1H3,(H,17,18).
What are the key properties of 3-ethyl-5-(3H-imidazo[4,5-c]quinolin-2-yl)-1,2-oxazole?
3-ethyl-5-(3H-imidazo[4,5-c]quinolin-2-yl)-1,2-oxazole has a molecular weight of 264.29 g/mol, XLogP of 3.33, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-(3H-imidazo[4,5-c]quinolin-2-yl)-1,2-oxazole is sourced from PubChem (CID 135417231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).