2-amino-4-(4-cyanophenyl)-5-ethyl-6-phenylpyridine-3-carbonitrile

C21H16N4 — CID 3402109

IUPAC2-amino-4-(4-cyanophenyl)-5-ethyl-6-phenylpyridine-3-carbonitrile
SMILESCCc1c(-c2ccccc2)nc(N)c(C#N)c1-c1ccc(C#N)cc1
InChIInChI=1S/C21H16N4/c1-2-17-19(15-10-8-14(12-22)9-11-15)18(13-23)21(24)25-20(17)16-6-4-3-5-7-16/h3-11H,2H2,1H3,(H2,24,25)
InChIKeyWZBHDPIBFPYBGX-UHFFFAOYSA-N
MW324.39 g/mol
LogP4.30
Rot. Bonds3

About 2-amino-4-(4-cyanophenyl)-5-ethyl-6-phenylpyridine-3-carbonitrile

2-amino-4-(4-cyanophenyl)-5-ethyl-6-phenylpyridine-3-carbonitrile (PubChem CID 3402109) has the molecular formula C21H16N4 and a molecular weight of 324.39 g/mol. Its IUPAC name is 2-amino-4-(4-cyanophenyl)-5-ethyl-6-phenylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-4-(4-cyanophenyl)-5-ethyl-6-phenylpyridine-3-carbonitrile
PubChem CID3402109
Molecular FormulaC21H16N4
Molecular Weight324.39 g/mol
Exact Mass324.14
IUPAC Name2-amino-4-(4-cyanophenyl)-5-ethyl-6-phenylpyridine-3-carbonitrile
SMILESCCc1c(-c2ccccc2)nc(N)c(C#N)c1-c1ccc(C#N)cc1
InChIInChI=1S/C21H16N4/c1-2-17-19(15-10-8-14(12-22)9-11-15)18(13-23)21(24)25-20(17)16-6-4-3-5-7-16/h3-11H,2H2,1H3,(H2,24,25)
InChIKeyWZBHDPIBFPYBGX-UHFFFAOYSA-N
XLogP4.30
TPSA86.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.39
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-5-ethyl-4-(4-methoxyphenyl)-6-phenylpyridine-3-carbonitrile
CID 856266
2-amino-4-(1,3-benzodioxol-5-yl)-5-ethyl-6-phenylpyridine-3-carbonitrile
CID 856305
2-amino-5-ethyl-6-phenyl-4-[3-(trifluoromethyl)phenyl]pyridine-3-carbonitrile
CID 3400568
2-amino-5-ethyl-4-(3-methylthiophen-2-yl)-6-phenylpyridine-3-carbonitrile
CID 5208157
2-amino-4-(4-bromothiophen-2-yl)-5-ethyl-6-phenylpyridine-3-carbonitrile
CID 5208158
2-amino-5-butyl-4-(3,4-dimethoxyphenyl)-6-phenylpyridine-3-carbonitrile
CID 3116796
2-amino-5-ethyl-4-(4-methylphenyl)-6-propylpyridine-3-carbonitrile
CID 4634975
2-amino-5,6-dimethyl-4-(4-phenylphenyl)pyridine-3-carbonitrile
CID 4633808
2-amino-4-naphthalen-2-yl-5-phenacyl-6-phenylpyridine-3-carbonitrile
CID 141419926
4-[2-(4-cyanophenyl)-5-ethyl-4-phenyl-3,6-dipyridin-2-ylphenyl]benzonitrile
CID 163734781
2-amino-6-(4-bromophenyl)-4-(4-ethylphenyl)-5-methylpyridine-3-carbonitrile
CID 3341400
4-[4-[4-(2,5,6-triphenylpyrimidin-4-yl)phenyl]phenyl]benzonitrile
CID 139525696

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-(4-cyanophenyl)-5-ethyl-6-phenylpyridine-3-carbonitrile?
The IUPAC name of 2-amino-4-(4-cyanophenyl)-5-ethyl-6-phenylpyridine-3-carbonitrile (CID 3402109) is 2-amino-4-(4-cyanophenyl)-5-ethyl-6-phenylpyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-4-(4-cyanophenyl)-5-ethyl-6-phenylpyridine-3-carbonitrile?
The canonical SMILES for 2-amino-4-(4-cyanophenyl)-5-ethyl-6-phenylpyridine-3-carbonitrile is CCc1c(-c2ccccc2)nc(N)c(C#N)c1-c1ccc(C#N)cc1.
What is the InChIKey of 2-amino-4-(4-cyanophenyl)-5-ethyl-6-phenylpyridine-3-carbonitrile?
The InChIKey is WZBHDPIBFPYBGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N4/c1-2-17-19(15-10-8-14(12-22)9-11-15)18(13-23)21(24)25-20(17)16-6-4-3-5-7-16/h3-11H,2H2,1H3,(H2,24,25).
What are the key properties of 2-amino-4-(4-cyanophenyl)-5-ethyl-6-phenylpyridine-3-carbonitrile?
2-amino-4-(4-cyanophenyl)-5-ethyl-6-phenylpyridine-3-carbonitrile has a molecular weight of 324.39 g/mol, XLogP of 4.30, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-(4-cyanophenyl)-5-ethyl-6-phenylpyridine-3-carbonitrile is sourced from PubChem (CID 3402109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).