2-(8-bromo-6-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile

C10H8BrN3 — CID 82530872

IUPAC2-(8-bromo-6-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile
SMILESCc1cc(Br)c2nc(CC#N)cn2c1
InChIInChI=1S/C10H8BrN3/c1-7-4-9(11)10-13-8(2-3-12)6-14(10)5-7/h4-6H,2H2,1H3
InChIKeyOHNJEADSIKQUKN-UHFFFAOYSA-N
MW250.10 g/mol
LogP2.47
Rot. Bonds1

About 2-(8-bromo-6-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile

2-(8-bromo-6-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile (PubChem CID 82530872) has the molecular formula C10H8BrN3 and a molecular weight of 250.10 g/mol. Its IUPAC name is 2-(8-bromo-6-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile.

Molecular Properties

Compound Name2-(8-bromo-6-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile
PubChem CID82530872
Molecular FormulaC10H8BrN3
Molecular Weight250.10 g/mol
Exact Mass248.99
IUPAC Name2-(8-bromo-6-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile
SMILESCc1cc(Br)c2nc(CC#N)cn2c1
InChIInChI=1S/C10H8BrN3/c1-7-4-9(11)10-13-8(2-3-12)6-14(10)5-7/h4-6H,2H2,1H3
InChIKeyOHNJEADSIKQUKN-UHFFFAOYSA-N
XLogP2.47
TPSA41.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.10
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(8-bromo-6-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile?
The IUPAC name of 2-(8-bromo-6-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile (CID 82530872) is 2-(8-bromo-6-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile.
What is the SMILES notation for 2-(8-bromo-6-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile?
The canonical SMILES for 2-(8-bromo-6-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile is Cc1cc(Br)c2nc(CC#N)cn2c1.
What is the InChIKey of 2-(8-bromo-6-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile?
The InChIKey is OHNJEADSIKQUKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrN3/c1-7-4-9(11)10-13-8(2-3-12)6-14(10)5-7/h4-6H,2H2,1H3.
What are the key properties of 2-(8-bromo-6-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile?
2-(8-bromo-6-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile has a molecular weight of 250.10 g/mol, XLogP of 2.47, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-bromo-6-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile is sourced from PubChem (CID 82530872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).