2-methyl-6-(3-methylpyrrolidin-1-yl)pyridine-4-carbonitrile

C12H15N3 — CID 114765932

IUPAC2-methyl-6-(3-methylpyrrolidin-1-yl)pyridine-4-carbonitrile
SMILESCc1cc(C#N)cc(N2CCC(C)C2)n1
InChIInChI=1S/C12H15N3/c1-9-3-4-15(8-9)12-6-11(7-13)5-10(2)14-12/h5-6,9H,3-4,8H2,1-2H3
InChIKeyPCQQDZDRTHBNRI-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.11
Rot. Bonds1

About 2-methyl-6-(3-methylpyrrolidin-1-yl)pyridine-4-carbonitrile

2-methyl-6-(3-methylpyrrolidin-1-yl)pyridine-4-carbonitrile (PubChem CID 114765932) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-methyl-6-(3-methylpyrrolidin-1-yl)pyridine-4-carbonitrile.

Molecular Properties

Compound Name2-methyl-6-(3-methylpyrrolidin-1-yl)pyridine-4-carbonitrile
PubChem CID114765932
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name2-methyl-6-(3-methylpyrrolidin-1-yl)pyridine-4-carbonitrile
SMILESCc1cc(C#N)cc(N2CCC(C)C2)n1
InChIInChI=1S/C12H15N3/c1-9-3-4-15(8-9)12-6-11(7-13)5-10(2)14-12/h5-6,9H,3-4,8H2,1-2H3
InChIKeyPCQQDZDRTHBNRI-UHFFFAOYSA-N
XLogP2.11
TPSA39.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-methyl-6-(3-methylpyrrolidin-1-yl)pyridine-4-carbonitrile 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

2-[(3R)-3-hydroxypyrrolidin-1-yl]-6-methylpyridine-4-carbonitrile
CID 104969574
2-[3-(1-hydroxyethyl)pyrrolidin-1-yl]-6-methylpyridine-4-carbonitrile
CID 114766561
2-(3-formylpiperidin-1-yl)-6-methylpyridine-4-carbonitrile
CID 114770482
2-[1-(4-cyano-6-methyl-2-pyridinyl)pyrrolidin-3-yl]acetic acid
CID 114765472
N-[1-(4-cyano-6-methyl-2-pyridinyl)piperidin-4-yl]acetamide
CID 114766577
2-(2-ethylthiomorpholin-4-yl)-6-methylpyridine-4-carbonitrile
CID 114766685
2-[4-(2-hydroxyethoxy)piperidin-1-yl]-6-methylpyridine-4-carbonitrile
CID 114766521
2-methyl-6-(3-methylpyrrolidin-1-yl)pyrimidin-4-amine
CID 80798590
2-[1-(4-cyano-6-methyl-2-pyridinyl)piperidin-4-yl]oxyacetic acid
CID 114765410
2-methyl-6-(3-methylthiomorpholin-4-yl)pyridine-4-carbonitrile
CID 114766322
2-[1-(4-cyano-6-methyl-2-pyridinyl)piperidin-3-yl]-2-methylpropanoic acid
CID 114765581
2-methyl-6-[4-(oxan-4-ylmethyl)piperazin-1-yl]pyridine-4-carbonitrile
CID 154757689

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(3-methylpyrrolidin-1-yl)pyridine-4-carbonitrile?
The IUPAC name of 2-methyl-6-(3-methylpyrrolidin-1-yl)pyridine-4-carbonitrile (CID 114765932) is 2-methyl-6-(3-methylpyrrolidin-1-yl)pyridine-4-carbonitrile.
What is the SMILES notation for 2-methyl-6-(3-methylpyrrolidin-1-yl)pyridine-4-carbonitrile?
The canonical SMILES for 2-methyl-6-(3-methylpyrrolidin-1-yl)pyridine-4-carbonitrile is Cc1cc(C#N)cc(N2CCC(C)C2)n1.
What is the InChIKey of 2-methyl-6-(3-methylpyrrolidin-1-yl)pyridine-4-carbonitrile?
The InChIKey is PCQQDZDRTHBNRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-9-3-4-15(8-9)12-6-11(7-13)5-10(2)14-12/h5-6,9H,3-4,8H2,1-2H3.
What are the key properties of 2-methyl-6-(3-methylpyrrolidin-1-yl)pyridine-4-carbonitrile?
2-methyl-6-(3-methylpyrrolidin-1-yl)pyridine-4-carbonitrile has a molecular weight of 201.27 g/mol, XLogP of 2.11, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(3-methylpyrrolidin-1-yl)pyridine-4-carbonitrile is sourced from PubChem (CID 114765932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).