3-[2-methoxyethyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanenitrile

C13H17N5O — CID 103385221

IUPAC3-[2-methoxyethyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanenitrile
SMILESCOCCN(CCC#N)c1nccc2c1ncn2C
InChIInChI=1S/C13H17N5O/c1-17-10-16-12-11(17)4-6-15-13(12)18(7-3-5-14)8-9-19-2/h4,6,10H,3,7-9H2,1-2H3
InChIKeyKJBMYQNSRRZQMJ-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.33
Rot. Bonds6

About 3-[2-methoxyethyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanenitrile

3-[2-methoxyethyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanenitrile (PubChem CID 103385221) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is 3-[2-methoxyethyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanenitrile.

Molecular Properties

Compound Name3-[2-methoxyethyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanenitrile
PubChem CID103385221
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC Name3-[2-methoxyethyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanenitrile
SMILESCOCCN(CCC#N)c1nccc2c1ncn2C
InChIInChI=1S/C13H17N5O/c1-17-10-16-12-11(17)4-6-15-13(12)18(7-3-5-14)8-9-19-2/h4,6,10H,3,7-9H2,1-2H3
InChIKeyKJBMYQNSRRZQMJ-UHFFFAOYSA-N
XLogP1.33
TPSA66.97 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 3-[2-methoxyethyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanenitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[(1-methylimidazo[4,5-c]pyridin-4-yl)-propan-2-ylamino]propanenitrile
CID 103385215
3-[2-methoxyethyl-(5-methoxyisoquinolin-1-yl)amino]propanenitrile
CID 106536675
3-[2-methoxyethyl(pyridin-4-yl)amino]propanenitrile
CID 55218453
3-[2-methoxyethyl(pyrimidin-2-yl)amino]propanenitrile
CID 63286973
N'-ethyl-N'-(1-methylimidazo[4,5-c]pyridin-4-yl)propane-1,3-diamine
CID 103385181
3-[2-methoxyethyl-(3-oxo-4-propylpyrazin-2-yl)amino]propanenitrile
CID 63286547
3-[methyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]butanenitrile
CID 103385220
3-[(6-hydrazinylimidazo[1,2-a]pyrazin-8-yl)-(2-methoxyethyl)amino]propanenitrile
CID 80914110
3-[2-methoxyethyl(pyridazin-3-yl)amino]propanenitrile
CID 63286635
3-[(2-amino-5-methylpyrimidin-4-yl)-(2-methoxyethyl)amino]propanenitrile
CID 80830637
3-[(5-amino-6-chloropyrimidin-4-yl)-(2-methoxyethyl)amino]propanenitrile
CID 63285179
3-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-(2-methoxyethyl)amino]propanenitrile
CID 80914663

Frequently Asked Questions

What is the IUPAC name of 3-[2-methoxyethyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanenitrile?
The IUPAC name of 3-[2-methoxyethyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanenitrile (CID 103385221) is 3-[2-methoxyethyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanenitrile.
What is the SMILES notation for 3-[2-methoxyethyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanenitrile?
The canonical SMILES for 3-[2-methoxyethyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanenitrile is COCCN(CCC#N)c1nccc2c1ncn2C.
What is the InChIKey of 3-[2-methoxyethyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanenitrile?
The InChIKey is KJBMYQNSRRZQMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c1-17-10-16-12-11(17)4-6-15-13(12)18(7-3-5-14)8-9-19-2/h4,6,10H,3,7-9H2,1-2H3.
What are the key properties of 3-[2-methoxyethyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanenitrile?
3-[2-methoxyethyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanenitrile has a molecular weight of 259.31 g/mol, XLogP of 1.33, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-methoxyethyl-(1-methylimidazo[4,5-c]pyridin-4-yl)amino]propanenitrile is sourced from PubChem (CID 103385221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).