2-[methyl(2-pyridin-3-ylethyl)amino]propanenitrile

C11H15N3 — CID 63264562

IUPAC2-[methyl(2-pyridin-3-ylethyl)amino]propanenitrile
SMILESCC(C#N)N(C)CCc1cccnc1
InChIInChI=1S/C11H15N3/c1-10(8-12)14(2)7-5-11-4-3-6-13-9-11/h3-4,6,9-10H,5,7H2,1-2H3
InChIKeyKMAAAURTGGHYGS-UHFFFAOYSA-N
MW189.26 g/mol
LogP1.47
Rot. Bonds4

About 2-[methyl(2-pyridin-3-ylethyl)amino]propanenitrile

2-[methyl(2-pyridin-3-ylethyl)amino]propanenitrile (PubChem CID 63264562) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is 2-[methyl(2-pyridin-3-ylethyl)amino]propanenitrile.

Molecular Properties

Compound Name2-[methyl(2-pyridin-3-ylethyl)amino]propanenitrile
PubChem CID63264562
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC Name2-[methyl(2-pyridin-3-ylethyl)amino]propanenitrile
SMILESCC(C#N)N(C)CCc1cccnc1
InChIInChI=1S/C11H15N3/c1-10(8-12)14(2)7-5-11-4-3-6-13-9-11/h3-4,6,9-10H,5,7H2,1-2H3
InChIKeyKMAAAURTGGHYGS-UHFFFAOYSA-N
XLogP1.47
TPSA39.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[methyl(2-pyridin-3-ylethyl)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

methyl(2-pyridin-3-ylethyl)cyanamide
CID 117043571
2-N-methyl-2-N-(2-pyridin-3-ylethyl)propane-1,2-diamine
CID 112708855
2-(dimethylamino)-3-pyridin-3-ylpropanenitrile
CID 82074886
2-[propyl(2-pyridin-3-ylethyl)amino]acetonitrile
CID 63264561
N-methyl-N-[2-(pyridin-3-ylmethoxy)ethyl]but-3-yn-2-amine
CID 175219429
1-N,4-dimethyl-1-N-(2-pyridin-3-ylethyl)pentane-1,3-diamine
CID 81490426
4-N-methyl-4-N-(2-pyridin-3-ylethyl)pyridine-3,4-diamine
CID 63262874
1-cyano-N-methyl-N-(2-pyridin-3-ylethyl)cyclopropane-1-carboxamide
CID 115181752
3-methyl-4-[methyl(2-pyridin-3-ylethyl)amino]butanoic acid
CID 115220133
2-ethyl-N'-methyl-N'-(2-pyridin-3-ylethyl)propane-1,3-diamine
CID 115251756
N'-propyl-N'-(2-pyridin-3-ylethyl)ethane-1,2-diamine
CID 63265157
2-methyl-3-(pyridin-3-ylmethylamino)propanenitrile
CID 43242702

Frequently Asked Questions

What is the IUPAC name of 2-[methyl(2-pyridin-3-ylethyl)amino]propanenitrile?
The IUPAC name of 2-[methyl(2-pyridin-3-ylethyl)amino]propanenitrile (CID 63264562) is 2-[methyl(2-pyridin-3-ylethyl)amino]propanenitrile.
What is the SMILES notation for 2-[methyl(2-pyridin-3-ylethyl)amino]propanenitrile?
The canonical SMILES for 2-[methyl(2-pyridin-3-ylethyl)amino]propanenitrile is CC(C#N)N(C)CCc1cccnc1.
What is the InChIKey of 2-[methyl(2-pyridin-3-ylethyl)amino]propanenitrile?
The InChIKey is KMAAAURTGGHYGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-10(8-12)14(2)7-5-11-4-3-6-13-9-11/h3-4,6,9-10H,5,7H2,1-2H3.
What are the key properties of 2-[methyl(2-pyridin-3-ylethyl)amino]propanenitrile?
2-[methyl(2-pyridin-3-ylethyl)amino]propanenitrile has a molecular weight of 189.26 g/mol, XLogP of 1.47, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl(2-pyridin-3-ylethyl)amino]propanenitrile is sourced from PubChem (CID 63264562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).