6-[benzyl(methyl)amino]-5-methylpyridine-3-carbonitrile

C15H15N3 — CID 102544753

IUPAC6-[benzyl(methyl)amino]-5-methylpyridine-3-carbonitrile
SMILESCc1cc(C#N)cnc1N(C)Cc1ccccc1
InChIInChI=1S/C15H15N3/c1-12-8-14(9-16)10-17-15(12)18(2)11-13-6-4-3-5-7-13/h3-8,10H,11H2,1-2H3
InChIKeyFYJMRJUWNQGKMY-UHFFFAOYSA-N
MW237.31 g/mol
LogP2.90
Rot. Bonds3

About 6-[benzyl(methyl)amino]-5-methylpyridine-3-carbonitrile

6-[benzyl(methyl)amino]-5-methylpyridine-3-carbonitrile (PubChem CID 102544753) has the molecular formula C15H15N3 and a molecular weight of 237.31 g/mol. Its IUPAC name is 6-[benzyl(methyl)amino]-5-methylpyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[benzyl(methyl)amino]-5-methylpyridine-3-carbonitrile
PubChem CID102544753
Molecular FormulaC15H15N3
Molecular Weight237.31 g/mol
Exact Mass237.13
IUPAC Name6-[benzyl(methyl)amino]-5-methylpyridine-3-carbonitrile
SMILESCc1cc(C#N)cnc1N(C)Cc1ccccc1
InChIInChI=1S/C15H15N3/c1-12-8-14(9-16)10-17-15(12)18(2)11-13-6-4-3-5-7-13/h3-8,10H,11H2,1-2H3
InChIKeyFYJMRJUWNQGKMY-UHFFFAOYSA-N
XLogP2.90
TPSA39.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[(5-bromo-3-methyl-2-pyridinyl)-methylamino]methyl]benzonitrile
CID 133373673
6-[benzyl(methyl)amino]pyridine-3-carbonitrile
CID 24690148
2-[6-[benzyl(methyl)amino]-5-methyl-3-pyridinyl]ethanol
CID 102544765
5-amino-6-[methyl(pyridin-3-ylmethyl)amino]pyridine-3-carbonitrile
CID 103467604
5-amino-6-[benzyl(propan-2-yl)amino]pyridine-3-carbonitrile
CID 103467234
3-[[(3,5-dichloro-2-pyridinyl)-methylamino]methyl]benzonitrile
CID 55025705
3-[[methyl-[5-methyl-2-(methylamino)pyrimidin-4-yl]amino]methyl]benzonitrile
CID 80823780
3-[[(6-chloro-5-methylpyrimidin-4-yl)-methylamino]methyl]benzonitrile
CID 63728710
N-benzyl-2-fluoro-N,5-dimethylpyrimidin-4-amine
CID 164655114
5-chloro-6-[(2,3-dichlorophenyl)methyl-methylamino]pyridine-3-carbonitrile
CID 51135200
5-amino-2-[benzyl(methyl)amino]pyridine-3-carboxylic acid
CID 82482899
2-N-benzyl-3-chloro-2-N-methylpyridine-2,5-diamine
CID 82480063

Frequently Asked Questions

What is the IUPAC name of 6-[benzyl(methyl)amino]-5-methylpyridine-3-carbonitrile?
The IUPAC name of 6-[benzyl(methyl)amino]-5-methylpyridine-3-carbonitrile (CID 102544753) is 6-[benzyl(methyl)amino]-5-methylpyridine-3-carbonitrile.
What is the SMILES notation for 6-[benzyl(methyl)amino]-5-methylpyridine-3-carbonitrile?
The canonical SMILES for 6-[benzyl(methyl)amino]-5-methylpyridine-3-carbonitrile is Cc1cc(C#N)cnc1N(C)Cc1ccccc1.
What is the InChIKey of 6-[benzyl(methyl)amino]-5-methylpyridine-3-carbonitrile?
The InChIKey is FYJMRJUWNQGKMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3/c1-12-8-14(9-16)10-17-15(12)18(2)11-13-6-4-3-5-7-13/h3-8,10H,11H2,1-2H3.
What are the key properties of 6-[benzyl(methyl)amino]-5-methylpyridine-3-carbonitrile?
6-[benzyl(methyl)amino]-5-methylpyridine-3-carbonitrile has a molecular weight of 237.31 g/mol, XLogP of 2.90, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[benzyl(methyl)amino]-5-methylpyridine-3-carbonitrile is sourced from PubChem (CID 102544753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).