6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine

C14H17N3 — CID 80755260

IUPAC6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine
SMILESCNc1cccc(Nc2ccc(C)c(C)c2)n1
InChIInChI=1S/C14H17N3/c1-10-7-8-12(9-11(10)2)16-14-6-4-5-13(15-3)17-14/h4-9H,1-3H3,(H2,15,16,17)
InChIKeyDBHNGXWTEOYNLL-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.48
Rot. Bonds3

About 6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine

6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine (PubChem CID 80755260) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is 6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine.

Molecular Properties

Compound Name6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine
PubChem CID80755260
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine
SMILESCNc1cccc(Nc2ccc(C)c(C)c2)n1
InChIInChI=1S/C14H17N3/c1-10-7-8-12(9-11(10)2)16-14-6-4-5-13(15-3)17-14/h4-9H,1-3H3,(H2,15,16,17)
InChIKeyDBHNGXWTEOYNLL-UHFFFAOYSA-N
XLogP3.48
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-N-(4-bromo-3-methylphenyl)-2-N-methylpyridine-2,6-diamine
CID 80759559
2-N-methyl-6-N-[4-methyl-3-(trifluoromethyl)phenyl]pyridine-2,6-diamine
CID 80812662
2-(3,4-dimethylanilino)quinolin-5-ol
CID 142739435
4-N-(3,4-dimethylphenyl)-6-N-methyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 80956276
4-N-(3,4-dimethylphenyl)-2-N,6-dimethylpyrimidine-2,4-diamine
CID 80754824
4-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,4-diamine
CID 113367409
2-[4-[[6-(methylamino)-2-pyridinyl]amino]anilino]ethanol
CID 69135632
2-N-methyl-6-N-(2-methylphenyl)pyridine-2,6-diamine
CID 80755629
2-(3,4-dimethylanilino)-4-methylquinolin-5-ol;hydrochloride
CID 135472794
6-chloro-N-(3-chloro-4-methylphenyl)pyridin-2-amine
CID 63585961
2-N,4-N-bis(3,4-dimethylphenyl)pyrimidine-2,4-diamine;hydrochloride
CID 71671107
6-bromo-N-(3-bromo-4-methylphenyl)pyridin-2-amine
CID 63961760

Frequently Asked Questions

What is the IUPAC name of 6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine?
The IUPAC name of 6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine (CID 80755260) is 6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine.
What is the SMILES notation for 6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine?
The canonical SMILES for 6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine is CNc1cccc(Nc2ccc(C)c(C)c2)n1.
What is the InChIKey of 6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine?
The InChIKey is DBHNGXWTEOYNLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-10-7-8-12(9-11(10)2)16-14-6-4-5-13(15-3)17-14/h4-9H,1-3H3,(H2,15,16,17).
What are the key properties of 6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine?
6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine has a molecular weight of 227.31 g/mol, XLogP of 3.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(3,4-dimethylphenyl)-2-N-methylpyridine-2,6-diamine is sourced from PubChem (CID 80755260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).