8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carbonitrile

C11H8BrN3 — CID 165132689

IUPAC8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carbonitrile
SMILESN#Cc1cn2cc(C3CC3)cc(Br)c2n1
InChIInChI=1S/C11H8BrN3/c12-10-3-8(7-1-2-7)5-15-6-9(4-13)14-11(10)15/h3,5-7H,1-2H2
InChIKeyMYZATGNITXDNOT-UHFFFAOYSA-N
MW262.11 g/mol
LogP2.85
Rot. Bonds1

About 8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carbonitrile

8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carbonitrile (PubChem CID 165132689) has the molecular formula C11H8BrN3 and a molecular weight of 262.11 g/mol. Its IUPAC name is 8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carbonitrile.

Molecular Properties

Compound Name8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carbonitrile
PubChem CID165132689
Molecular FormulaC11H8BrN3
Molecular Weight262.11 g/mol
Exact Mass260.99
IUPAC Name8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carbonitrile
SMILESN#Cc1cn2cc(C3CC3)cc(Br)c2n1
InChIInChI=1S/C11H8BrN3/c12-10-3-8(7-1-2-7)5-15-6-9(4-13)14-11(10)15/h3,5-7H,1-2H2
InChIKeyMYZATGNITXDNOT-UHFFFAOYSA-N
XLogP2.85
TPSA41.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.11
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carbonitrile?
The IUPAC name of 8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carbonitrile (CID 165132689) is 8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carbonitrile.
What is the SMILES notation for 8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carbonitrile?
The canonical SMILES for 8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carbonitrile is N#Cc1cn2cc(C3CC3)cc(Br)c2n1.
What is the InChIKey of 8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carbonitrile?
The InChIKey is MYZATGNITXDNOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8BrN3/c12-10-3-8(7-1-2-7)5-15-6-9(4-13)14-11(10)15/h3,5-7H,1-2H2.
What are the key properties of 8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carbonitrile?
8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carbonitrile has a molecular weight of 262.11 g/mol, XLogP of 2.85, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-6-cyclopropylimidazo[1,2-a]pyridine-2-carbonitrile is sourced from PubChem (CID 165132689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).