2-(8-hydroxy-2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile

C10H9N3O — CID 13338266

IUPAC2-(8-hydroxy-2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile
SMILESCc1nc2c(O)cccn2c1CC#N
InChIInChI=1S/C10H9N3O/c1-7-8(4-5-11)13-6-2-3-9(14)10(13)12-7/h2-3,6,14H,4H2,1H3
InChIKeyOQYGXNFGWLDYKB-UHFFFAOYSA-N
MW187.20 g/mol
LogP1.41
Rot. Bonds1

About 2-(8-hydroxy-2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile

2-(8-hydroxy-2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile (PubChem CID 13338266) has the molecular formula C10H9N3O and a molecular weight of 187.20 g/mol. Its IUPAC name is 2-(8-hydroxy-2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile.

Molecular Properties

Compound Name2-(8-hydroxy-2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile
PubChem CID13338266
Molecular FormulaC10H9N3O
Molecular Weight187.20 g/mol
Exact Mass187.07
IUPAC Name2-(8-hydroxy-2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile
SMILESCc1nc2c(O)cccn2c1CC#N
InChIInChI=1S/C10H9N3O/c1-7-8(4-5-11)13-6-2-3-9(14)10(13)12-7/h2-3,6,14H,4H2,1H3
InChIKeyOQYGXNFGWLDYKB-UHFFFAOYSA-N
XLogP1.41
TPSA61.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.20
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(8-hydroxy-2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile?
The IUPAC name of 2-(8-hydroxy-2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile (CID 13338266) is 2-(8-hydroxy-2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile.
What is the SMILES notation for 2-(8-hydroxy-2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile?
The canonical SMILES for 2-(8-hydroxy-2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile is Cc1nc2c(O)cccn2c1CC#N.
What is the InChIKey of 2-(8-hydroxy-2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile?
The InChIKey is OQYGXNFGWLDYKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O/c1-7-8(4-5-11)13-6-2-3-9(14)10(13)12-7/h2-3,6,14H,4H2,1H3.
What are the key properties of 2-(8-hydroxy-2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile?
2-(8-hydroxy-2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile has a molecular weight of 187.20 g/mol, XLogP of 1.41, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-hydroxy-2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile is sourced from PubChem (CID 13338266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).