6-methyl-2-N-(4-phenylphenyl)pyridine-2,3-diamine

C18H17N3 — CID 81140251

IUPAC6-methyl-2-N-(4-phenylphenyl)pyridine-2,3-diamine
SMILESCc1ccc(N)c(Nc2ccc(-c3ccccc3)cc2)n1
InChIInChI=1S/C18H17N3/c1-13-7-12-17(19)18(20-13)21-16-10-8-15(9-11-16)14-5-3-2-4-6-14/h2-12H,19H2,1H3,(H,20,21)
InChIKeyIKCNSJBKJDFWFG-UHFFFAOYSA-N
MW275.36 g/mol
LogP4.38
Rot. Bonds3

About 6-methyl-2-N-(4-phenylphenyl)pyridine-2,3-diamine

6-methyl-2-N-(4-phenylphenyl)pyridine-2,3-diamine (PubChem CID 81140251) has the molecular formula C18H17N3 and a molecular weight of 275.36 g/mol. Its IUPAC name is 6-methyl-2-N-(4-phenylphenyl)pyridine-2,3-diamine.

Molecular Properties

Compound Name6-methyl-2-N-(4-phenylphenyl)pyridine-2,3-diamine
PubChem CID81140251
Molecular FormulaC18H17N3
Molecular Weight275.36 g/mol
Exact Mass275.14
IUPAC Name6-methyl-2-N-(4-phenylphenyl)pyridine-2,3-diamine
SMILESCc1ccc(N)c(Nc2ccc(-c3ccccc3)cc2)n1
InChIInChI=1S/C18H17N3/c1-13-7-12-17(19)18(20-13)21-16-10-8-15(9-11-16)14-5-3-2-4-6-14/h2-12H,19H2,1H3,(H,20,21)
InChIKeyIKCNSJBKJDFWFG-UHFFFAOYSA-N
XLogP4.38
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 54.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-N-(4-phenylphenyl)pyridine-2,3-diamine?
The IUPAC name of 6-methyl-2-N-(4-phenylphenyl)pyridine-2,3-diamine (CID 81140251) is 6-methyl-2-N-(4-phenylphenyl)pyridine-2,3-diamine.
What is the SMILES notation for 6-methyl-2-N-(4-phenylphenyl)pyridine-2,3-diamine?
The canonical SMILES for 6-methyl-2-N-(4-phenylphenyl)pyridine-2,3-diamine is Cc1ccc(N)c(Nc2ccc(-c3ccccc3)cc2)n1.
What is the InChIKey of 6-methyl-2-N-(4-phenylphenyl)pyridine-2,3-diamine?
The InChIKey is IKCNSJBKJDFWFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3/c1-13-7-12-17(19)18(20-13)21-16-10-8-15(9-11-16)14-5-3-2-4-6-14/h2-12H,19H2,1H3,(H,20,21).
What are the key properties of 6-methyl-2-N-(4-phenylphenyl)pyridine-2,3-diamine?
6-methyl-2-N-(4-phenylphenyl)pyridine-2,3-diamine has a molecular weight of 275.36 g/mol, XLogP of 4.38, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-N-(4-phenylphenyl)pyridine-2,3-diamine is sourced from PubChem (CID 81140251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).