2,6-dianilino-4-methylpyridine-3-carbonitrile

C19H16N4 — CID 11956691

IUPAC2,6-dianilino-4-methylpyridine-3-carbonitrile
SMILESCc1cc(Nc2ccccc2)nc(Nc2ccccc2)c1C#N
InChIInChI=1S/C19H16N4/c1-14-12-18(21-15-8-4-2-5-9-15)23-19(17(14)13-20)22-16-10-6-3-7-11-16/h2-12H,1H3,(H2,21,22,23)
InChIKeyTYFMUVFYDRDOBX-UHFFFAOYSA-N
MW300.37 g/mol
LogP4.75
Rot. Bonds4

About 2,6-dianilino-4-methylpyridine-3-carbonitrile

2,6-dianilino-4-methylpyridine-3-carbonitrile (PubChem CID 11956691) has the molecular formula C19H16N4 and a molecular weight of 300.37 g/mol. Its IUPAC name is 2,6-dianilino-4-methylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2,6-dianilino-4-methylpyridine-3-carbonitrile
PubChem CID11956691
Molecular FormulaC19H16N4
Molecular Weight300.37 g/mol
Exact Mass300.14
IUPAC Name2,6-dianilino-4-methylpyridine-3-carbonitrile
SMILESCc1cc(Nc2ccccc2)nc(Nc2ccccc2)c1C#N
InChIInChI=1S/C19H16N4/c1-14-12-18(21-15-8-4-2-5-9-15)23-19(17(14)13-20)22-16-10-6-3-7-11-16/h2-12H,1H3,(H2,21,22,23)
InChIKeyTYFMUVFYDRDOBX-UHFFFAOYSA-N
XLogP4.75
TPSA60.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.37
LogP ≤ 54.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-dianilino-4-methylpyridine-3-carbonitrile?
The IUPAC name of 2,6-dianilino-4-methylpyridine-3-carbonitrile (CID 11956691) is 2,6-dianilino-4-methylpyridine-3-carbonitrile.
What is the SMILES notation for 2,6-dianilino-4-methylpyridine-3-carbonitrile?
The canonical SMILES for 2,6-dianilino-4-methylpyridine-3-carbonitrile is Cc1cc(Nc2ccccc2)nc(Nc2ccccc2)c1C#N.
What is the InChIKey of 2,6-dianilino-4-methylpyridine-3-carbonitrile?
The InChIKey is TYFMUVFYDRDOBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4/c1-14-12-18(21-15-8-4-2-5-9-15)23-19(17(14)13-20)22-16-10-6-3-7-11-16/h2-12H,1H3,(H2,21,22,23).
What are the key properties of 2,6-dianilino-4-methylpyridine-3-carbonitrile?
2,6-dianilino-4-methylpyridine-3-carbonitrile has a molecular weight of 300.37 g/mol, XLogP of 4.75, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dianilino-4-methylpyridine-3-carbonitrile is sourced from PubChem (CID 11956691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).