2-(dipropylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile

C16H22N4 — CID 84756914

IUPAC2-(dipropylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile
SMILESCCCN(CCC)C(C#N)c1c(C)nc2ccccn12
InChIInChI=1S/C16H22N4/c1-4-9-19(10-5-2)14(12-17)16-13(3)18-15-8-6-7-11-20(15)16/h6-8,11,14H,4-5,9-10H2,1-3H3
InChIKeyAAAOXZMDISCGNB-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.33
Rot. Bonds6

About 2-(dipropylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile

2-(dipropylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile (PubChem CID 84756914) has the molecular formula C16H22N4 and a molecular weight of 270.38 g/mol. Its IUPAC name is 2-(dipropylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile.

Molecular Properties

Compound Name2-(dipropylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile
PubChem CID84756914
Molecular FormulaC16H22N4
Molecular Weight270.38 g/mol
Exact Mass270.18
IUPAC Name2-(dipropylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile
SMILESCCCN(CCC)C(C#N)c1c(C)nc2ccccn12
InChIInChI=1S/C16H22N4/c1-4-9-19(10-5-2)14(12-17)16-13(3)18-15-8-6-7-11-20(15)16/h6-8,11,14H,4-5,9-10H2,1-3H3
InChIKeyAAAOXZMDISCGNB-UHFFFAOYSA-N
XLogP3.33
TPSA44.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile
CID 84816712
N'-butyl-N'-methyl-1-(2-methylimidazo[1,2-a]pyridin-3-yl)ethane-1,2-diamine
CID 82028820
2-(2-methylimidazo[1,2-a]pyridin-3-yl)-2-(2-phenylethylamino)acetonitrile
CID 84816983
2-(2-propan-2-ylimidazo[1,2-a]pyridin-3-yl)propanenitrile
CID 82029947
(4-butylcyclohexyl)-(2-methylimidazo[1,2-a]pyridin-3-yl)methanamine
CID 82029185
2,2,2-trifluoro-1-(2-methylimidazo[1,2-a]pyridin-3-yl)ethanamine
CID 82029187
2-(2-methylimidazo[1,2-a]pyridin-3-yl)-2-(oxolan-2-ylmethylamino)acetonitrile
CID 84817050
bis(diethylamino)-methyl-(2-methylimidazo[1,2-a]pyridin-3-yl)phosphanium
CID 3421015
3-[[3-(bromomethyl)imidazo[1,2-a]pyridin-2-yl]-methylamino]propanenitrile
CID 107079501
ethane;2-methyl-3-pentylimidazo[1,2-a]pyridine
CID 91437982
2-[[[(1R)-1-(2-bromophenyl)ethyl]-propylamino]methyl]pyrido[1,2-a]pyrimidin-4-one
CID 94841447
4-[(2-methylimidazo[1,2-a]pyridin-3-yl)methyl]benzonitrile;hydrochloride
CID 19032464

Frequently Asked Questions

What is the IUPAC name of 2-(dipropylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile?
The IUPAC name of 2-(dipropylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile (CID 84756914) is 2-(dipropylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile.
What is the SMILES notation for 2-(dipropylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile?
The canonical SMILES for 2-(dipropylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile is CCCN(CCC)C(C#N)c1c(C)nc2ccccn12.
What is the InChIKey of 2-(dipropylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile?
The InChIKey is AAAOXZMDISCGNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N4/c1-4-9-19(10-5-2)14(12-17)16-13(3)18-15-8-6-7-11-20(15)16/h6-8,11,14H,4-5,9-10H2,1-3H3.
What are the key properties of 2-(dipropylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile?
2-(dipropylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile has a molecular weight of 270.38 g/mol, XLogP of 3.33, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dipropylamino)-2-(2-methylimidazo[1,2-a]pyridin-3-yl)acetonitrile is sourced from PubChem (CID 84756914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).