6-N-(4-methyl-3-pyridinyl)-4-phenylpyridine-2,6-diamine

C17H16N4 — CID 154724374

IUPAC6-N-(4-methyl-3-pyridinyl)-4-phenylpyridine-2,6-diamine
SMILESCc1ccncc1Nc1cc(-c2ccccc2)cc(N)n1
InChIInChI=1S/C17H16N4/c1-12-7-8-19-11-15(12)20-17-10-14(9-16(18)21-17)13-5-3-2-4-6-13/h2-11H,1H3,(H3,18,20,21)
InChIKeyDXZCGJJYWLMKAY-UHFFFAOYSA-N
MW276.34 g/mol
LogP3.78
Rot. Bonds3

About 6-N-(4-methyl-3-pyridinyl)-4-phenylpyridine-2,6-diamine

6-N-(4-methyl-3-pyridinyl)-4-phenylpyridine-2,6-diamine (PubChem CID 154724374) has the molecular formula C17H16N4 and a molecular weight of 276.34 g/mol. Its IUPAC name is 6-N-(4-methyl-3-pyridinyl)-4-phenylpyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-(4-methyl-3-pyridinyl)-4-phenylpyridine-2,6-diamine
PubChem CID154724374
Molecular FormulaC17H16N4
Molecular Weight276.34 g/mol
Exact Mass276.14
IUPAC Name6-N-(4-methyl-3-pyridinyl)-4-phenylpyridine-2,6-diamine
SMILESCc1ccncc1Nc1cc(-c2ccccc2)cc(N)n1
InChIInChI=1S/C17H16N4/c1-12-7-8-19-11-15(12)20-17-10-14(9-16(18)21-17)13-5-3-2-4-6-13/h2-11H,1H3,(H3,18,20,21)
InChIKeyDXZCGJJYWLMKAY-UHFFFAOYSA-N
XLogP3.78
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-N-(4-methyl-3-pyridinyl)-4-phenylpyridine-2,6-diamine?
The IUPAC name of 6-N-(4-methyl-3-pyridinyl)-4-phenylpyridine-2,6-diamine (CID 154724374) is 6-N-(4-methyl-3-pyridinyl)-4-phenylpyridine-2,6-diamine.
What is the SMILES notation for 6-N-(4-methyl-3-pyridinyl)-4-phenylpyridine-2,6-diamine?
The canonical SMILES for 6-N-(4-methyl-3-pyridinyl)-4-phenylpyridine-2,6-diamine is Cc1ccncc1Nc1cc(-c2ccccc2)cc(N)n1.
What is the InChIKey of 6-N-(4-methyl-3-pyridinyl)-4-phenylpyridine-2,6-diamine?
The InChIKey is DXZCGJJYWLMKAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4/c1-12-7-8-19-11-15(12)20-17-10-14(9-16(18)21-17)13-5-3-2-4-6-13/h2-11H,1H3,(H3,18,20,21).
What are the key properties of 6-N-(4-methyl-3-pyridinyl)-4-phenylpyridine-2,6-diamine?
6-N-(4-methyl-3-pyridinyl)-4-phenylpyridine-2,6-diamine has a molecular weight of 276.34 g/mol, XLogP of 3.78, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(4-methyl-3-pyridinyl)-4-phenylpyridine-2,6-diamine is sourced from PubChem (CID 154724374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).