2-(bromomethylidene)-3,5-dihydro-1H-imidazo[1,2-a]pyridine

C8H9BrN2 — CID 139030571

IUPAC2-(bromomethylidene)-3,5-dihydro-1H-imidazo[1,2-a]pyridine
SMILESBrC=C1CN2CC=CC=C2N1
InChIInChI=1S/C8H9BrN2/c9-5-7-6-11-4-2-1-3-8(11)10-7/h1-3,5,10H,4,6H2
InChIKeyKHKAGLAIWGLCFC-UHFFFAOYSA-N
MW213.08 g/mol
LogP1.54
Rot. Bonds

About 2-(bromomethylidene)-3,5-dihydro-1H-imidazo[1,2-a]pyridine

2-(bromomethylidene)-3,5-dihydro-1H-imidazo[1,2-a]pyridine (PubChem CID 139030571) has the molecular formula C8H9BrN2 and a molecular weight of 213.08 g/mol. Its IUPAC name is 2-(bromomethylidene)-3,5-dihydro-1H-imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-(bromomethylidene)-3,5-dihydro-1H-imidazo[1,2-a]pyridine
PubChem CID139030571
Molecular FormulaC8H9BrN2
Molecular Weight213.08 g/mol
Exact Mass211.99
IUPAC Name2-(bromomethylidene)-3,5-dihydro-1H-imidazo[1,2-a]pyridine
SMILESBrC=C1CN2CC=CC=C2N1
InChIInChI=1S/C8H9BrN2/c9-5-7-6-11-4-2-1-3-8(11)10-7/h1-3,5,10H,4,6H2
InChIKeyKHKAGLAIWGLCFC-UHFFFAOYSA-N
XLogP1.54
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.08
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(bromomethylidene)-3,5-dihydro-1H-imidazo[1,2-a]pyridine?
The IUPAC name of 2-(bromomethylidene)-3,5-dihydro-1H-imidazo[1,2-a]pyridine (CID 139030571) is 2-(bromomethylidene)-3,5-dihydro-1H-imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-(bromomethylidene)-3,5-dihydro-1H-imidazo[1,2-a]pyridine?
The canonical SMILES for 2-(bromomethylidene)-3,5-dihydro-1H-imidazo[1,2-a]pyridine is BrC=C1CN2CC=CC=C2N1.
What is the InChIKey of 2-(bromomethylidene)-3,5-dihydro-1H-imidazo[1,2-a]pyridine?
The InChIKey is KHKAGLAIWGLCFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9BrN2/c9-5-7-6-11-4-2-1-3-8(11)10-7/h1-3,5,10H,4,6H2.
What are the key properties of 2-(bromomethylidene)-3,5-dihydro-1H-imidazo[1,2-a]pyridine?
2-(bromomethylidene)-3,5-dihydro-1H-imidazo[1,2-a]pyridine has a molecular weight of 213.08 g/mol, XLogP of 1.54, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(bromomethylidene)-3,5-dihydro-1H-imidazo[1,2-a]pyridine is sourced from PubChem (CID 139030571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).