2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetonitrile

C9H7N3O — CID 131519071

IUPAC2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetonitrile
SMILESN#CCc1cn2cc(O)ccc2n1
InChIInChI=1S/C9H7N3O/c10-4-3-7-5-12-6-8(13)1-2-9(12)11-7/h1-2,5-6,13H,3H2
InChIKeyXBJWROJZFXZBDS-UHFFFAOYSA-N
MW173.17 g/mol
LogP1.11
Rot. Bonds1

About 2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetonitrile

2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetonitrile (PubChem CID 131519071) has the molecular formula C9H7N3O and a molecular weight of 173.17 g/mol. Its IUPAC name is 2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetonitrile.

Molecular Properties

Compound Name2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetonitrile
PubChem CID131519071
Molecular FormulaC9H7N3O
Molecular Weight173.17 g/mol
Exact Mass173.06
IUPAC Name2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetonitrile
SMILESN#CCc1cn2cc(O)ccc2n1
InChIInChI=1S/C9H7N3O/c10-4-3-7-5-12-6-8(13)1-2-9(12)11-7/h1-2,5-6,13H,3H2
InChIKeyXBJWROJZFXZBDS-UHFFFAOYSA-N
XLogP1.11
TPSA61.32 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.17
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-hydroxyethyl)imidazo[1,2-a]pyridin-6-ol
CID 115015092
2-(7-methylimidazo[1,2-a]pyridin-2-yl)acetonitrile
CID 82055270
methyl 2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetate
CID 131340084
2-[(2-bromophenyl)methyl]imidazo[1,2-a]pyridin-6-ol
CID 117130489
2-(furan-2-ylmethyl)imidazo[1,2-a]pyridin-6-ol
CID 117130980
2-(thian-4-ylmethyl)imidazo[1,2-a]pyridin-6-ol
CID 117129235
tert-butyl 2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetate
CID 135396821
propan-2-yl 2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetate
CID 135394863
2-[(1,1-dioxothian-4-yl)methyl]imidazo[1,2-a]pyridin-6-ol
CID 117129225
2-[(1,1-dioxothiolan-2-yl)methyl]imidazo[1,2-a]pyridin-6-ol
CID 117129794
6-hydroxyimidazo[1,2-a]pyridine-2-carbaldehyde
CID 105431793
2-[(1-ethylpyrrolidin-2-yl)methyl]imidazo[1,2-a]pyridin-6-ol
CID 117129838

Frequently Asked Questions

What is the IUPAC name of 2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetonitrile?
The IUPAC name of 2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetonitrile (CID 131519071) is 2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetonitrile.
What is the SMILES notation for 2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetonitrile?
The canonical SMILES for 2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetonitrile is N#CCc1cn2cc(O)ccc2n1.
What is the InChIKey of 2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetonitrile?
The InChIKey is XBJWROJZFXZBDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N3O/c10-4-3-7-5-12-6-8(13)1-2-9(12)11-7/h1-2,5-6,13H,3H2.
What are the key properties of 2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetonitrile?
2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetonitrile has a molecular weight of 173.17 g/mol, XLogP of 1.11, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-hydroxyimidazo[1,2-a]pyridin-2-yl)acetonitrile is sourced from PubChem (CID 131519071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).