2-(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile

C13H15N3 — CID 82029947

IUPAC2-(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile
SMILESCC(C)c1nc2ccccn2c1C(C)C#N
InChIInChI=1S/C13H15N3/c1-9(2)12-13(10(3)8-14)16-7-5-4-6-11(16)15-12/h4-7,9-10H,1-3H3
InChIKeyWJHMPNGNWMLSDY-UHFFFAOYSA-N
MW213.28 g/mol
LogP3.08
Rot. Bonds2

About 2-(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile

2-(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile (PubChem CID 82029947) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 2-(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile.

Molecular Properties

Compound Name2-(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile
PubChem CID82029947
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC Name2-(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile
SMILESCC(C)c1nc2ccccn2c1C(C)C#N
InChIInChI=1S/C13H15N3/c1-9(2)12-13(10(3)8-14)16-7-5-4-6-11(16)15-12/h4-7,9-10H,1-3H3
InChIKeyWJHMPNGNWMLSDY-UHFFFAOYSA-N
XLogP3.08
TPSA41.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(6-bromo-2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile
CID 82030084
2-(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanethioamide
CID 82030163
3-nitroso-2-propan-2-ylimidazo[1,2-a]pyridine
CID 82356248
2-bromo-3-propan-2-ylimidazo[1,2-a]pyridine
CID 84701100
(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)methanamine
CID 82504617
2-propan-2-ylimidazo[1,2-a]pyridine-3-carbaldehyde
CID 76849577
2-propan-2-ylimidazo[1,2-a]pyridine-3-sulfonyl chloride
CID 141336153
2-(ethylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile
CID 84816712
2-(1-chloroethyl)-3-methylimidazo[1,2-a]pyridine
CID 66646648
2,3-di(propan-2-yl)imidazo[1,2-a]pyrazine;2,3-di(propan-2-yl)imidazo[1,2-a]pyridine;2,3-di(propan-2-yl)imidazo[1,2-a]pyrimidine;2,3-di(propan-2-yl)imidazo[1,2-b]pyridazine
CID 160584696
2-(dipropylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile
CID 84756914
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-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile?
The IUPAC name of 2-(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile (CID 82029947) is 2-(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile.
What is the SMILES notation for 2-(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile?
The canonical SMILES for 2-(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile is CC(C)c1nc2ccccn2c1C(C)C#N.
What is the InChIKey of 2-(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile?
The InChIKey is WJHMPNGNWMLSDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-9(2)12-13(10(3)8-14)16-7-5-4-6-11(16)15-12/h4-7,9-10H,1-3H3.
What are the key properties of 2-(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile?
2-(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile has a molecular weight of 213.28 g/mol, XLogP of 3.08, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile is sourced from PubChem (CID 82029947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).