3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile

C11H15N5 — CID 103467847

IUPAC3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile
SMILESCN1CCC(Nc2ccc(N)c(C#N)n2)C1
InChIInChI=1S/C11H15N5/c1-16-5-4-8(7-16)14-11-3-2-9(13)10(6-12)15-11/h2-3,8H,4-5,7,13H2,1H3,(H,14,15)
InChIKeyJHVATADRDFNGPQ-UHFFFAOYSA-N
MW217.28 g/mol
LogP0.65
Rot. Bonds2

About 3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile

3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile (PubChem CID 103467847) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile.

Molecular Properties

Compound Name3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile
PubChem CID103467847
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile
SMILESCN1CCC(Nc2ccc(N)c(C#N)n2)C1
InChIInChI=1S/C11H15N5/c1-16-5-4-8(7-16)14-11-3-2-9(13)10(6-12)15-11/h2-3,8H,4-5,7,13H2,1H3,(H,14,15)
InChIKeyJHVATADRDFNGPQ-UHFFFAOYSA-N
XLogP0.65
TPSA77.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-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

6-N-(1-methylpyrrolidin-3-yl)pyridine-2,3,6-triamine
CID 79826028
3-amino-6-[(1-methylpiperidin-4-yl)methylamino]pyridine-2-carbonitrile
CID 103468076
4-[(1-methylpyrrolidin-3-yl)amino]-2-oxo-1H-pyrimidine-6-carbonitrile
CID 115143508
6-tert-butyl-4-N-(1-methylpyrrolidin-3-yl)pyrimidine-2,4-diamine
CID 66740280
5-methyl-2-N-(1-methylpyrrolidin-3-yl)pyridine-2,4-diamine
CID 83266421
5-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carboxamide
CID 114405789
2-chloro-6-methyl-N-(1-methylpyrrolidin-3-yl)pyrimidin-4-amine
CID 62481987
3-amino-6-(morpholin-4-ylamino)pyridine-2-carbonitrile
CID 103468941
4-bromo-2-N-(1-methylpyrrolidin-3-yl)benzene-1,2-diamine
CID 65343279
2-N-(1,3-dimethylpiperidin-4-yl)-6-methylpyridine-2,5-diamine
CID 114503076
methyl 5-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carboxylate
CID 114405790
6-[(1-methylpyrrolidin-3-yl)amino]pyridine-3-carboxylic acid
CID 61465352

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile?
The IUPAC name of 3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile (CID 103467847) is 3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile.
What is the SMILES notation for 3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile?
The canonical SMILES for 3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile is CN1CCC(Nc2ccc(N)c(C#N)n2)C1.
What is the InChIKey of 3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile?
The InChIKey is JHVATADRDFNGPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-16-5-4-8(7-16)14-11-3-2-9(13)10(6-12)15-11/h2-3,8H,4-5,7,13H2,1H3,(H,14,15).
What are the key properties of 3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile?
3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile has a molecular weight of 217.28 g/mol, XLogP of 0.65, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-[(1-methylpyrrolidin-3-yl)amino]pyridine-2-carbonitrile is sourced from PubChem (CID 103467847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).