3-cyclopropyl-5-imidazo[1,5-a]quinolin-3-yl-1,2,4-oxadiazole

C16H12N4O — CID 67925365

IUPAC3-cyclopropyl-5-imidazo[1,5-a]quinolin-3-yl-1,2,4-oxadiazole
SMILESc1ccc2c(c1)ccc1c(-c3nc(C4CC4)no3)ncn12
InChIInChI=1S/C16H12N4O/c1-2-4-12-10(3-1)7-8-13-14(17-9-20(12)13)16-18-15(19-21-16)11-5-6-11/h1-4,7-9,11H,5-6H2
InChIKeyNUDDOIYKYIZZDE-UHFFFAOYSA-N
MW276.30 g/mol
LogP3.41
Rot. Bonds2

About 3-cyclopropyl-5-imidazo[1,5-a]quinolin-3-yl-1,2,4-oxadiazole

3-cyclopropyl-5-imidazo[1,5-a]quinolin-3-yl-1,2,4-oxadiazole (PubChem CID 67925365) has the molecular formula C16H12N4O and a molecular weight of 276.30 g/mol. Its IUPAC name is 3-cyclopropyl-5-imidazo[1,5-a]quinolin-3-yl-1,2,4-oxadiazole.

Molecular Properties

Compound Name3-cyclopropyl-5-imidazo[1,5-a]quinolin-3-yl-1,2,4-oxadiazole
PubChem CID67925365
Molecular FormulaC16H12N4O
Molecular Weight276.30 g/mol
Exact Mass276.10
IUPAC Name3-cyclopropyl-5-imidazo[1,5-a]quinolin-3-yl-1,2,4-oxadiazole
SMILESc1ccc2c(c1)ccc1c(-c3nc(C4CC4)no3)ncn12
InChIInChI=1S/C16H12N4O/c1-2-4-12-10(3-1)7-8-13-14(17-9-20(12)13)16-18-15(19-21-16)11-5-6-11/h1-4,7-9,11H,5-6H2
InChIKeyNUDDOIYKYIZZDE-UHFFFAOYSA-N
XLogP3.41
TPSA56.22 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.30
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-5-imidazo[1,5-a]quinolin-3-yl-1,2,4-oxadiazole?
The IUPAC name of 3-cyclopropyl-5-imidazo[1,5-a]quinolin-3-yl-1,2,4-oxadiazole (CID 67925365) is 3-cyclopropyl-5-imidazo[1,5-a]quinolin-3-yl-1,2,4-oxadiazole.
What is the SMILES notation for 3-cyclopropyl-5-imidazo[1,5-a]quinolin-3-yl-1,2,4-oxadiazole?
The canonical SMILES for 3-cyclopropyl-5-imidazo[1,5-a]quinolin-3-yl-1,2,4-oxadiazole is c1ccc2c(c1)ccc1c(-c3nc(C4CC4)no3)ncn12.
What is the InChIKey of 3-cyclopropyl-5-imidazo[1,5-a]quinolin-3-yl-1,2,4-oxadiazole?
The InChIKey is NUDDOIYKYIZZDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N4O/c1-2-4-12-10(3-1)7-8-13-14(17-9-20(12)13)16-18-15(19-21-16)11-5-6-11/h1-4,7-9,11H,5-6H2.
What are the key properties of 3-cyclopropyl-5-imidazo[1,5-a]quinolin-3-yl-1,2,4-oxadiazole?
3-cyclopropyl-5-imidazo[1,5-a]quinolin-3-yl-1,2,4-oxadiazole has a molecular weight of 276.30 g/mol, XLogP of 3.41, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-5-imidazo[1,5-a]quinolin-3-yl-1,2,4-oxadiazole is sourced from PubChem (CID 67925365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).