6-(3,4-dimethylphenyl)-2-hydrazinyl-4-phenylpyridine-3-carbonitrile

C20H18N4 — CID 71325021

IUPAC6-(3,4-dimethylphenyl)-2-hydrazinyl-4-phenylpyridine-3-carbonitrile
SMILESCc1ccc(-c2cc(-c3ccccc3)c(C#N)c(NN)n2)cc1C
InChIInChI=1S/C20H18N4/c1-13-8-9-16(10-14(13)2)19-11-17(15-6-4-3-5-7-15)18(12-21)20(23-19)24-22/h3-11H,22H2,1-2H3,(H,23,24)
InChIKeyTXYVXIOSJWEVPL-UHFFFAOYSA-N
MW314.39 g/mol
LogP4.19
Rot. Bonds3

About 6-(3,4-dimethylphenyl)-2-hydrazinyl-4-phenylpyridine-3-carbonitrile

6-(3,4-dimethylphenyl)-2-hydrazinyl-4-phenylpyridine-3-carbonitrile (PubChem CID 71325021) has the molecular formula C20H18N4 and a molecular weight of 314.39 g/mol. Its IUPAC name is 6-(3,4-dimethylphenyl)-2-hydrazinyl-4-phenylpyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(3,4-dimethylphenyl)-2-hydrazinyl-4-phenylpyridine-3-carbonitrile
PubChem CID71325021
Molecular FormulaC20H18N4
Molecular Weight314.39 g/mol
Exact Mass314.15
IUPAC Name6-(3,4-dimethylphenyl)-2-hydrazinyl-4-phenylpyridine-3-carbonitrile
SMILESCc1ccc(-c2cc(-c3ccccc3)c(C#N)c(NN)n2)cc1C
InChIInChI=1S/C20H18N4/c1-13-8-9-16(10-14(13)2)19-11-17(15-6-4-3-5-7-15)18(12-21)20(23-19)24-22/h3-11H,22H2,1-2H3,(H,23,24)
InChIKeyTXYVXIOSJWEVPL-UHFFFAOYSA-N
XLogP4.19
TPSA74.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 54.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2-methylanilino)-4,6-diphenylpyridine-3-carbonitrile
CID 35214913
2-methyl-4,6-diphenylpyridine-3-carbonitrile
CID 4135564
2-(2-methoxyanilino)-4,6-diphenylpyridine-3-carbonitrile
CID 3966942
6-(4-methylphenyl)-2,4-diphenylpyridine-3-carbonitrile
CID 12575122
2-amino-6-(3,4-dimethylphenyl)-4-(4-nitrophenyl)pyridine-3-carbonitrile
CID 3485199
2-(4-methoxyanilino)-4,6-diphenylpyridine-3-carbonitrile
CID 3360693
2-ethyl-4,6-diphenylpyridine-3-carbonitrile
CID 102404081
2-amino-4-(4-tert-butylphenyl)-6-phenylpyridine-3-carbonitrile
CID 3350002
2-amino-4-(4-chloro-3-fluorophenyl)-6-(3,4-dimethylphenyl)pyridine-3-carbonitrile
CID 3498060
2-amino-6-(3,4-dimethylphenyl)-4-(3,4,5-trimethoxyphenyl)pyridine-3-carbonitrile
CID 3502077
2-(cyclohexylamino)-4,6-diphenylpyridine-3-carbonitrile
CID 3439401
copper;2,4-dimethyl-6-phenylpyridine-3-carbonitrile;dibromide
CID 68902117

Frequently Asked Questions

What is the IUPAC name of 6-(3,4-dimethylphenyl)-2-hydrazinyl-4-phenylpyridine-3-carbonitrile?
The IUPAC name of 6-(3,4-dimethylphenyl)-2-hydrazinyl-4-phenylpyridine-3-carbonitrile (CID 71325021) is 6-(3,4-dimethylphenyl)-2-hydrazinyl-4-phenylpyridine-3-carbonitrile.
What is the SMILES notation for 6-(3,4-dimethylphenyl)-2-hydrazinyl-4-phenylpyridine-3-carbonitrile?
The canonical SMILES for 6-(3,4-dimethylphenyl)-2-hydrazinyl-4-phenylpyridine-3-carbonitrile is Cc1ccc(-c2cc(-c3ccccc3)c(C#N)c(NN)n2)cc1C.
What is the InChIKey of 6-(3,4-dimethylphenyl)-2-hydrazinyl-4-phenylpyridine-3-carbonitrile?
The InChIKey is TXYVXIOSJWEVPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N4/c1-13-8-9-16(10-14(13)2)19-11-17(15-6-4-3-5-7-15)18(12-21)20(23-19)24-22/h3-11H,22H2,1-2H3,(H,23,24).
What are the key properties of 6-(3,4-dimethylphenyl)-2-hydrazinyl-4-phenylpyridine-3-carbonitrile?
6-(3,4-dimethylphenyl)-2-hydrazinyl-4-phenylpyridine-3-carbonitrile has a molecular weight of 314.39 g/mol, XLogP of 4.19, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-dimethylphenyl)-2-hydrazinyl-4-phenylpyridine-3-carbonitrile is sourced from PubChem (CID 71325021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).