2-[2-(bromomethyl)cyclopropyl]imidazo[1,2-a]pyridine

C11H11BrN2 — CID 81350556

IUPAC2-[2-(bromomethyl)cyclopropyl]imidazo[1,2-a]pyridine
SMILESBrCC1CC1c1cn2ccccc2n1
InChIInChI=1S/C11H11BrN2/c12-6-8-5-9(8)10-7-14-4-2-1-3-11(14)13-10/h1-4,7-9H,5-6H2
InChIKeyQRGSQCUKCOCRQH-UHFFFAOYSA-N
MW251.13 g/mol
LogP2.83
Rot. Bonds2

About 2-[2-(bromomethyl)cyclopropyl]imidazo[1,2-a]pyridine

2-[2-(bromomethyl)cyclopropyl]imidazo[1,2-a]pyridine (PubChem CID 81350556) has the molecular formula C11H11BrN2 and a molecular weight of 251.13 g/mol. Its IUPAC name is 2-[2-(bromomethyl)cyclopropyl]imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-[2-(bromomethyl)cyclopropyl]imidazo[1,2-a]pyridine
PubChem CID81350556
Molecular FormulaC11H11BrN2
Molecular Weight251.13 g/mol
Exact Mass250.01
IUPAC Name2-[2-(bromomethyl)cyclopropyl]imidazo[1,2-a]pyridine
SMILESBrCC1CC1c1cn2ccccc2n1
InChIInChI=1S/C11H11BrN2/c12-6-8-5-9(8)10-7-14-4-2-1-3-11(14)13-10/h1-4,7-9H,5-6H2
InChIKeyQRGSQCUKCOCRQH-UHFFFAOYSA-N
XLogP2.83
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.13
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[2-(bromomethyl)cyclopropyl]imidazo[1,2-a]pyridine?
The IUPAC name of 2-[2-(bromomethyl)cyclopropyl]imidazo[1,2-a]pyridine (CID 81350556) is 2-[2-(bromomethyl)cyclopropyl]imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-[2-(bromomethyl)cyclopropyl]imidazo[1,2-a]pyridine?
The canonical SMILES for 2-[2-(bromomethyl)cyclopropyl]imidazo[1,2-a]pyridine is BrCC1CC1c1cn2ccccc2n1.
What is the InChIKey of 2-[2-(bromomethyl)cyclopropyl]imidazo[1,2-a]pyridine?
The InChIKey is QRGSQCUKCOCRQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11BrN2/c12-6-8-5-9(8)10-7-14-4-2-1-3-11(14)13-10/h1-4,7-9H,5-6H2.
What are the key properties of 2-[2-(bromomethyl)cyclopropyl]imidazo[1,2-a]pyridine?
2-[2-(bromomethyl)cyclopropyl]imidazo[1,2-a]pyridine has a molecular weight of 251.13 g/mol, XLogP of 2.83, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(bromomethyl)cyclopropyl]imidazo[1,2-a]pyridine is sourced from PubChem (CID 81350556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).