2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile

C17H15N3O — CID 82060342

IUPAC2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile
SMILESCC(C)Oc1ccc(-c2cn3cc(C#N)ccc3n2)cc1
InChIInChI=1S/C17H15N3O/c1-12(2)21-15-6-4-14(5-7-15)16-11-20-10-13(9-18)3-8-17(20)19-16/h3-8,10-12H,1-2H3
InChIKeyANJNHDIEUMWTKV-UHFFFAOYSA-N
MW277.33 g/mol
LogP3.66
Rot. Bonds3

About 2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile

2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile (PubChem CID 82060342) has the molecular formula C17H15N3O and a molecular weight of 277.33 g/mol. Its IUPAC name is 2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile.

Molecular Properties

Compound Name2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile
PubChem CID82060342
Molecular FormulaC17H15N3O
Molecular Weight277.33 g/mol
Exact Mass277.12
IUPAC Name2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile
SMILESCC(C)Oc1ccc(-c2cn3cc(C#N)ccc3n2)cc1
InChIInChI=1S/C17H15N3O/c1-12(2)21-15-6-4-14(5-7-15)16-11-20-10-13(9-18)3-8-17(20)19-16/h3-8,10-12H,1-2H3
InChIKeyANJNHDIEUMWTKV-UHFFFAOYSA-N
XLogP3.66
TPSA50.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]methanol
CID 82356958
6-bromo-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 115404928
2-(3-methoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile
CID 82060343
2-(2,5-dimethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile
CID 82060349
2-(4-propan-2-yloxyphenyl)pyridine-4-carbonitrile
CID 117001819
[2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanol
CID 82064349
tert-butyl 2-[[2-(4-cyanophenyl)imidazo[1,2-a]pyridine-6-carbonyl]amino]propanoate
CID 54128795
2-(3-methyl-4-phenylmethoxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile
CID 58191859
6-bromo-5-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 115403727
4-(4-imidazo[1,2-a]pyridin-2-ylphenyl)benzonitrile
CID 141122443
11-oxo-2-propan-2-yloxypyrido[2,1-b]quinazoline-8-carbonitrile
CID 13052297
6-bromo-2-(4-methoxyphenyl)imidazo[1,2-a]pyridine;hydroiodide
CID 19238090

Frequently Asked Questions

What is the IUPAC name of 2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile?
The IUPAC name of 2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile (CID 82060342) is 2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile.
What is the SMILES notation for 2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile?
The canonical SMILES for 2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile is CC(C)Oc1ccc(-c2cn3cc(C#N)ccc3n2)cc1.
What is the InChIKey of 2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile?
The InChIKey is ANJNHDIEUMWTKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O/c1-12(2)21-15-6-4-14(5-7-15)16-11-20-10-13(9-18)3-8-17(20)19-16/h3-8,10-12H,1-2H3.
What are the key properties of 2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile?
2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile has a molecular weight of 277.33 g/mol, XLogP of 3.66, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine-6-carbonitrile is sourced from PubChem (CID 82060342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).