4,6-dimethyl-2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-3-carbonitrile

C16H24N4 — CID 62992143

IUPAC4,6-dimethyl-2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-3-carbonitrile
SMILESCc1cc(C)c(C#N)c(NCC(C)CN2CCCC2)n1
InChIInChI=1S/C16H24N4/c1-12(11-20-6-4-5-7-20)10-18-16-15(9-17)13(2)8-14(3)19-16/h8,12H,4-7,10-11H2,1-3H3,(H,18,19)
InChIKeyHNSUTJZAGSBKOJ-UHFFFAOYSA-N
MW272.40 g/mol
LogP2.71
Rot. Bonds5

About 4,6-dimethyl-2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-3-carbonitrile

4,6-dimethyl-2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-3-carbonitrile (PubChem CID 62992143) has the molecular formula C16H24N4 and a molecular weight of 272.40 g/mol. Its IUPAC name is 4,6-dimethyl-2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-3-carbonitrile.

Molecular Properties

Compound Name4,6-dimethyl-2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-3-carbonitrile
PubChem CID62992143
Molecular FormulaC16H24N4
Molecular Weight272.40 g/mol
Exact Mass272.20
IUPAC Name4,6-dimethyl-2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-3-carbonitrile
SMILESCc1cc(C)c(C#N)c(NCC(C)CN2CCCC2)n1
InChIInChI=1S/C16H24N4/c1-12(11-20-6-4-5-7-20)10-18-16-15(9-17)13(2)8-14(3)19-16/h8,12H,4-7,10-11H2,1-3H3,(H,18,19)
InChIKeyHNSUTJZAGSBKOJ-UHFFFAOYSA-N
XLogP2.71
TPSA51.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.40
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4,6-dimethyl-2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-3-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-methyl-6-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-4-carbonitrile
CID 114766247
2-[2-(azepan-1-yl)ethylamino]-4,6-dimethylpyridine-3-carbonitrile
CID 61240776
4,6-dimethyl-2-[(3-methyl-2-propan-2-ylbutyl)amino]pyridine-3-carbonitrile
CID 102906163
4-[[3-(4-ethylpiperazin-1-yl)-2-methylpropyl]amino]-2,6-dimethylpyridine-3-carbonitrile
CID 133396909
4,6-dimethyl-2-(2,3,3-trimethylbutylamino)pyridine-3-carbonitrile
CID 78966758
4,6-dimethyl-2-(1-morpholin-4-ylpropan-2-ylamino)pyridine-3-carbonitrile
CID 60965079
2-(2,3-dihydroxypropylamino)-4,6-dimethylpyridine-3-carbonitrile
CID 66177763
6-methyl-N-(2-methyl-3-piperidin-1-ylpropyl)-2-propan-2-ylpyrimidin-4-amine
CID 60967444
2-(cyclopentylmethylamino)-4,6-dimethylpyridine-3-carbonitrile
CID 43428254
4,6-dimethyl-2-[[2-(3-methylphenyl)-2-morpholin-4-ylethyl]amino]pyridine-3-carbonitrile
CID 78871346
3-methyl-N-(2-methyl-3-pyrrolidin-1-ylpropyl)quinoxalin-2-amine
CID 62993510
6-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]-5-nitropyridine-3-carbonitrile
CID 103471625

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-3-carbonitrile?
The IUPAC name of 4,6-dimethyl-2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-3-carbonitrile (CID 62992143) is 4,6-dimethyl-2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-3-carbonitrile.
What is the SMILES notation for 4,6-dimethyl-2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-3-carbonitrile?
The canonical SMILES for 4,6-dimethyl-2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-3-carbonitrile is Cc1cc(C)c(C#N)c(NCC(C)CN2CCCC2)n1.
What is the InChIKey of 4,6-dimethyl-2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-3-carbonitrile?
The InChIKey is HNSUTJZAGSBKOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4/c1-12(11-20-6-4-5-7-20)10-18-16-15(9-17)13(2)8-14(3)19-16/h8,12H,4-7,10-11H2,1-3H3,(H,18,19).
What are the key properties of 4,6-dimethyl-2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-3-carbonitrile?
4,6-dimethyl-2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-3-carbonitrile has a molecular weight of 272.40 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-2-[(2-methyl-3-pyrrolidin-1-ylpropyl)amino]pyridine-3-carbonitrile is sourced from PubChem (CID 62992143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).