6-bromo-8-chloro-2,3-dimethyl-3-phenylimidazo[1,5-a]pyridine-1,5-dione

C15H12BrClN2O2 — CID 144985885

IUPAC6-bromo-8-chloro-2,3-dimethyl-3-phenylimidazo[1,5-a]pyridine-1,5-dione
SMILESCN1C(=O)c2c(Cl)cc(Br)c(=O)n2C1(C)c1ccccc1
InChIInChI=1S/C15H12BrClN2O2/c1-15(9-6-4-3-5-7-9)18(2)14(21)12-11(17)8-10(16)13(20)19(12)15/h3-8H,1-2H3
InChIKeyNHRNKEFWHYBNQR-UHFFFAOYSA-N
MW367.63 g/mol
LogP3.07
Rot. Bonds1

About 6-bromo-8-chloro-2,3-dimethyl-3-phenylimidazo[1,5-a]pyridine-1,5-dione

6-bromo-8-chloro-2,3-dimethyl-3-phenylimidazo[1,5-a]pyridine-1,5-dione (PubChem CID 144985885) has the molecular formula C15H12BrClN2O2 and a molecular weight of 367.63 g/mol. Its IUPAC name is 6-bromo-8-chloro-2,3-dimethyl-3-phenylimidazo[1,5-a]pyridine-1,5-dione.

Molecular Properties

Compound Name6-bromo-8-chloro-2,3-dimethyl-3-phenylimidazo[1,5-a]pyridine-1,5-dione
PubChem CID144985885
Molecular FormulaC15H12BrClN2O2
Molecular Weight367.63 g/mol
Exact Mass365.98
IUPAC Name6-bromo-8-chloro-2,3-dimethyl-3-phenylimidazo[1,5-a]pyridine-1,5-dione
SMILESCN1C(=O)c2c(Cl)cc(Br)c(=O)n2C1(C)c1ccccc1
InChIInChI=1S/C15H12BrClN2O2/c1-15(9-6-4-3-5-7-9)18(2)14(21)12-11(17)8-10(16)13(20)19(12)15/h3-8H,1-2H3
InChIKeyNHRNKEFWHYBNQR-UHFFFAOYSA-N
XLogP3.07
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.63
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-8-chloro-2,3-dimethyl-3-phenylimidazo[1,5-a]pyridine-1,5-dione?
The IUPAC name of 6-bromo-8-chloro-2,3-dimethyl-3-phenylimidazo[1,5-a]pyridine-1,5-dione (CID 144985885) is 6-bromo-8-chloro-2,3-dimethyl-3-phenylimidazo[1,5-a]pyridine-1,5-dione.
What is the SMILES notation for 6-bromo-8-chloro-2,3-dimethyl-3-phenylimidazo[1,5-a]pyridine-1,5-dione?
The canonical SMILES for 6-bromo-8-chloro-2,3-dimethyl-3-phenylimidazo[1,5-a]pyridine-1,5-dione is CN1C(=O)c2c(Cl)cc(Br)c(=O)n2C1(C)c1ccccc1.
What is the InChIKey of 6-bromo-8-chloro-2,3-dimethyl-3-phenylimidazo[1,5-a]pyridine-1,5-dione?
The InChIKey is NHRNKEFWHYBNQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrClN2O2/c1-15(9-6-4-3-5-7-9)18(2)14(21)12-11(17)8-10(16)13(20)19(12)15/h3-8H,1-2H3.
What are the key properties of 6-bromo-8-chloro-2,3-dimethyl-3-phenylimidazo[1,5-a]pyridine-1,5-dione?
6-bromo-8-chloro-2,3-dimethyl-3-phenylimidazo[1,5-a]pyridine-1,5-dione has a molecular weight of 367.63 g/mol, XLogP of 3.07, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-chloro-2,3-dimethyl-3-phenylimidazo[1,5-a]pyridine-1,5-dione is sourced from PubChem (CID 144985885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).