ethane;2-(2-methylimidazo[1,2-a]pyridin-6-yl)propanenitrile

C13H17N3 — CID 156793511

IUPACethane;2-(2-methylimidazo[1,2-a]pyridin-6-yl)propanenitrile
SMILESCC.Cc1cn2cc(C(C)C#N)ccc2n1
InChIInChI=1S/C11H11N3.C2H6/c1-8(5-12)10-3-4-11-13-9(2)6-14(11)7-10;1-2/h3-4,6-8H,1-2H3;1-2H3
InChIKeyWAXBZOLMBZLJII-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.30
Rot. Bonds1

About ethane;2-(2-methylimidazo[1,2-a]pyridin-6-yl)propanenitrile

ethane;2-(2-methylimidazo[1,2-a]pyridin-6-yl)propanenitrile (PubChem CID 156793511) has the molecular formula C13H17N3 and a molecular weight of 215.30 g/mol. Its IUPAC name is ethane;2-(2-methylimidazo[1,2-a]pyridin-6-yl)propanenitrile.

Molecular Properties

Compound Nameethane;2-(2-methylimidazo[1,2-a]pyridin-6-yl)propanenitrile
PubChem CID156793511
Molecular FormulaC13H17N3
Molecular Weight215.30 g/mol
Exact Mass215.14
IUPAC Nameethane;2-(2-methylimidazo[1,2-a]pyridin-6-yl)propanenitrile
SMILESCC.Cc1cn2cc(C(C)C#N)ccc2n1
InChIInChI=1S/C11H11N3.C2H6/c1-8(5-12)10-3-4-11-13-9(2)6-14(11)7-10;1-2/h3-4,6-8H,1-2H3;1-2H3
InChIKeyWAXBZOLMBZLJII-UHFFFAOYSA-N
XLogP3.30
TPSA41.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-1-(2-methylimidazo[1,2-a]pyridin-6-yl)ethanol
CID 83829797
2-methyl-6-(2-methylpropyl)imidazo[1,2-a]pyridine
CID 118488947
6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 177158713
2-[3-(1-cyanoethyl)-5-methylphenyl]propanenitrile
CID 89362177
ethane;2-phenylpropanenitrile
CID 91366777
6-fluoro-2-methylimidazo[1,2-a]pyridine;formamide
CID 143999441
(2S)-2-(4-iodophenyl)propanenitrile
CID 135394754
2-(6-methyl-2-phenylimidazo[1,2-a]pyridin-3-yl)propanenitrile
CID 82029976
(Z)-2-[amino(propan-2-yl)amino]-1-(2-methylimidazo[1,2-a]pyridin-6-yl)ethenamine
CID 142598036
6-propan-2-ylimidazo[1,2-a]pyridine-2-carboxylic acid
CID 68615554
2,5-dimethylimidazo[1,2-a]pyridine-6-carbonitrile
CID 82060852
6-(2-chloro-3-pyridinyl)-2-methylimidazo[1,2-a]pyridine
CID 90095843

Frequently Asked Questions

What is the IUPAC name of ethane;2-(2-methylimidazo[1,2-a]pyridin-6-yl)propanenitrile?
The IUPAC name of ethane;2-(2-methylimidazo[1,2-a]pyridin-6-yl)propanenitrile (CID 156793511) is ethane;2-(2-methylimidazo[1,2-a]pyridin-6-yl)propanenitrile.
What is the SMILES notation for ethane;2-(2-methylimidazo[1,2-a]pyridin-6-yl)propanenitrile?
The canonical SMILES for ethane;2-(2-methylimidazo[1,2-a]pyridin-6-yl)propanenitrile is CC.Cc1cn2cc(C(C)C#N)ccc2n1.
What is the InChIKey of ethane;2-(2-methylimidazo[1,2-a]pyridin-6-yl)propanenitrile?
The InChIKey is WAXBZOLMBZLJII-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3.C2H6/c1-8(5-12)10-3-4-11-13-9(2)6-14(11)7-10;1-2/h3-4,6-8H,1-2H3;1-2H3.
What are the key properties of ethane;2-(2-methylimidazo[1,2-a]pyridin-6-yl)propanenitrile?
ethane;2-(2-methylimidazo[1,2-a]pyridin-6-yl)propanenitrile has a molecular weight of 215.30 g/mol, XLogP of 3.30, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-(2-methylimidazo[1,2-a]pyridin-6-yl)propanenitrile is sourced from PubChem (CID 156793511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).