5-amino-2-methyl-6-phenylpyridine-3,4-dicarbonitrile

C14H10N4 — CID 71323044

IUPAC5-amino-2-methyl-6-phenylpyridine-3,4-dicarbonitrile
SMILESCc1nc(-c2ccccc2)c(N)c(C#N)c1C#N
InChIInChI=1S/C14H10N4/c1-9-11(7-15)12(8-16)13(17)14(18-9)10-5-3-2-4-6-10/h2-6H,17H2,1H3
InChIKeyAAGHCZBKOCXRFK-UHFFFAOYSA-N
MW234.26 g/mol
LogP2.38
Rot. Bonds1

About 5-amino-2-methyl-6-phenylpyridine-3,4-dicarbonitrile

5-amino-2-methyl-6-phenylpyridine-3,4-dicarbonitrile (PubChem CID 71323044) has the molecular formula C14H10N4 and a molecular weight of 234.26 g/mol. Its IUPAC name is 5-amino-2-methyl-6-phenylpyridine-3,4-dicarbonitrile.

Molecular Properties

Compound Name5-amino-2-methyl-6-phenylpyridine-3,4-dicarbonitrile
PubChem CID71323044
Molecular FormulaC14H10N4
Molecular Weight234.26 g/mol
Exact Mass234.09
IUPAC Name5-amino-2-methyl-6-phenylpyridine-3,4-dicarbonitrile
SMILESCc1nc(-c2ccccc2)c(N)c(C#N)c1C#N
InChIInChI=1S/C14H10N4/c1-9-11(7-15)12(8-16)13(17)14(18-9)10-5-3-2-4-6-10/h2-6H,17H2,1H3
InChIKeyAAGHCZBKOCXRFK-UHFFFAOYSA-N
XLogP2.38
TPSA86.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.26
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Adx 10059
CID 10331863
ST001233
CID 610514
3-[(6-Methylpyridin-2-yl)ethynyl]benzonitrile
CID 11378977
2-Methylquinoline-4-carbonitrile
CID 657495
6-(Cyano(4-fluorophenyl)methyl)-3-methylpicolinonitrile (26)
CID 56604871
6-(Cyano(4-fluorophenyl)methyl)picolinonitrile (25)
CID 56851824
(2-(3-Fluoro-phenylethynyl)-6-methyl-pyridin-3-yl)amine
CID 9837457
2-Chloro-4-methyl-6-phenylnicotinonitrile
CID 833688
2-Methyl-6-phenylpyridine
CID 2762885
2,4,6-Trimethyl-3-pyridinamine
CID 98846
2-Amino-5,6-dimethyl-4-phenylnicotinonitrile
CID 650363
3-[2-(6-Ethyl-2-pyridinyl)ethynyl]benzonitrile
CID 70695479

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-methyl-6-phenylpyridine-3,4-dicarbonitrile?
The IUPAC name of 5-amino-2-methyl-6-phenylpyridine-3,4-dicarbonitrile (CID 71323044) is 5-amino-2-methyl-6-phenylpyridine-3,4-dicarbonitrile.
What is the SMILES notation for 5-amino-2-methyl-6-phenylpyridine-3,4-dicarbonitrile?
The canonical SMILES for 5-amino-2-methyl-6-phenylpyridine-3,4-dicarbonitrile is Cc1nc(-c2ccccc2)c(N)c(C#N)c1C#N.
What is the InChIKey of 5-amino-2-methyl-6-phenylpyridine-3,4-dicarbonitrile?
The InChIKey is AAGHCZBKOCXRFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N4/c1-9-11(7-15)12(8-16)13(17)14(18-9)10-5-3-2-4-6-10/h2-6H,17H2,1H3.
What are the key properties of 5-amino-2-methyl-6-phenylpyridine-3,4-dicarbonitrile?
5-amino-2-methyl-6-phenylpyridine-3,4-dicarbonitrile has a molecular weight of 234.26 g/mol, XLogP of 2.38, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-methyl-6-phenylpyridine-3,4-dicarbonitrile is sourced from PubChem (CID 71323044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).