2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile

C19H19N3O — CID 82030016

IUPAC2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile
SMILESCCOc1ccc(-c2nc3cc(C)ccn3c2C(C)C#N)cc1
InChIInChI=1S/C19H19N3O/c1-4-23-16-7-5-15(6-8-16)18-19(14(3)12-20)22-10-9-13(2)11-17(22)21-18/h5-11,14H,4H2,1-3H3
InChIKeyVRXWADDUIFDHLW-UHFFFAOYSA-N
MW305.38 g/mol
LogP4.34
Rot. Bonds4

About 2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile

2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile (PubChem CID 82030016) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is 2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile.

Molecular Properties

Compound Name2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile
PubChem CID82030016
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC Name2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile
SMILESCCOc1ccc(-c2nc3cc(C)ccn3c2C(C)C#N)cc1
InChIInChI=1S/C19H19N3O/c1-4-23-16-7-5-15(6-8-16)18-19(14(3)12-20)22-10-9-13(2)11-17(22)21-18/h5-11,14H,4H2,1-3H3
InChIKeyVRXWADDUIFDHLW-UHFFFAOYSA-N
XLogP4.34
TPSA50.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[7-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridin-3-yl]propanenitrile
CID 82030006
2-[7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
CID 82030415
3-(1-chloroethyl)-7-methyl-2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 82029854
[7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 39199352
1-[2-(4-bromophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]ethanol
CID 82029416
2-[7-methyl-2-(4-phenylphenyl)imidazo[1,2-a]pyridin-3-yl]propan-1-amine
CID 82030409
1-[2-(4-fluorophenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propan-1-ol
CID 82029619
4-ethoxy-N-(7-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)benzenesulfonamide
CID 25042588
2-[2-(4-fluorophenyl)-6-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile
CID 82029983
N-butyl-N-[3-[4-(3,7-dimethylimidazo[1,2-a]pyridin-2-yl)phenoxy]propyl]butan-1-amine
CID 14773969
(E)-3-[7-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-3-yl]prop-2-enoic acid
CID 39195944
2-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanenitrile
CID 82029976

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile?
The IUPAC name of 2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile (CID 82030016) is 2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile.
What is the SMILES notation for 2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile?
The canonical SMILES for 2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile is CCOc1ccc(-c2nc3cc(C)ccn3c2C(C)C#N)cc1.
What is the InChIKey of 2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile?
The InChIKey is VRXWADDUIFDHLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-4-23-16-7-5-15(6-8-16)18-19(14(3)12-20)22-10-9-13(2)11-17(22)21-18/h5-11,14H,4H2,1-3H3.
What are the key properties of 2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile?
2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile has a molecular weight of 305.38 g/mol, XLogP of 4.34, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-ethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanenitrile is sourced from PubChem (CID 82030016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).