6-N-(2,4-dimethylphenyl)-2-N,6-N-dimethylpyridine-2,6-diamine

C15H19N3 — CID 80818401

IUPAC6-N-(2,4-dimethylphenyl)-2-N,6-N-dimethylpyridine-2,6-diamine
SMILESCNc1cccc(N(C)c2ccc(C)cc2C)n1
InChIInChI=1S/C15H19N3/c1-11-8-9-13(12(2)10-11)18(4)15-7-5-6-14(16-3)17-15/h5-10H,1-4H3,(H,16,17)
InChIKeyFNQQTKNLJZGURB-UHFFFAOYSA-N
MW241.34 g/mol
LogP3.51
Rot. Bonds3

About 6-N-(2,4-dimethylphenyl)-2-N,6-N-dimethylpyridine-2,6-diamine

6-N-(2,4-dimethylphenyl)-2-N,6-N-dimethylpyridine-2,6-diamine (PubChem CID 80818401) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 6-N-(2,4-dimethylphenyl)-2-N,6-N-dimethylpyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-(2,4-dimethylphenyl)-2-N,6-N-dimethylpyridine-2,6-diamine
PubChem CID80818401
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name6-N-(2,4-dimethylphenyl)-2-N,6-N-dimethylpyridine-2,6-diamine
SMILESCNc1cccc(N(C)c2ccc(C)cc2C)n1
InChIInChI=1S/C15H19N3/c1-11-8-9-13(12(2)10-11)18(4)15-7-5-6-14(16-3)17-15/h5-10H,1-4H3,(H,16,17)
InChIKeyFNQQTKNLJZGURB-UHFFFAOYSA-N
XLogP3.51
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-N-(2,4-dimethylphenyl)-2-N,6-N-dimethylpyridine-2,6-diamine?
The IUPAC name of 6-N-(2,4-dimethylphenyl)-2-N,6-N-dimethylpyridine-2,6-diamine (CID 80818401) is 6-N-(2,4-dimethylphenyl)-2-N,6-N-dimethylpyridine-2,6-diamine.
What is the SMILES notation for 6-N-(2,4-dimethylphenyl)-2-N,6-N-dimethylpyridine-2,6-diamine?
The canonical SMILES for 6-N-(2,4-dimethylphenyl)-2-N,6-N-dimethylpyridine-2,6-diamine is CNc1cccc(N(C)c2ccc(C)cc2C)n1.
What is the InChIKey of 6-N-(2,4-dimethylphenyl)-2-N,6-N-dimethylpyridine-2,6-diamine?
The InChIKey is FNQQTKNLJZGURB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-11-8-9-13(12(2)10-11)18(4)15-7-5-6-14(16-3)17-15/h5-10H,1-4H3,(H,16,17).
What are the key properties of 6-N-(2,4-dimethylphenyl)-2-N,6-N-dimethylpyridine-2,6-diamine?
6-N-(2,4-dimethylphenyl)-2-N,6-N-dimethylpyridine-2,6-diamine has a molecular weight of 241.34 g/mol, XLogP of 3.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(2,4-dimethylphenyl)-2-N,6-N-dimethylpyridine-2,6-diamine is sourced from PubChem (CID 80818401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).