5-N-(2,4-dimethylphenyl)-3-N-methylpyridine-3,5-diamine

C14H17N3 — CID 104532337

IUPAC5-N-(2,4-dimethylphenyl)-3-N-methylpyridine-3,5-diamine
SMILESCNc1cncc(Nc2ccc(C)cc2C)c1
InChIInChI=1S/C14H17N3/c1-10-4-5-14(11(2)6-10)17-13-7-12(15-3)8-16-9-13/h4-9,15,17H,1-3H3
InChIKeyNOADOJDXYPDIGK-UHFFFAOYSA-N
MW227.31 g/mol
LogP3.48
Rot. Bonds3

About 5-N-(2,4-dimethylphenyl)-3-N-methylpyridine-3,5-diamine

5-N-(2,4-dimethylphenyl)-3-N-methylpyridine-3,5-diamine (PubChem CID 104532337) has the molecular formula C14H17N3 and a molecular weight of 227.31 g/mol. Its IUPAC name is 5-N-(2,4-dimethylphenyl)-3-N-methylpyridine-3,5-diamine.

Molecular Properties

Compound Name5-N-(2,4-dimethylphenyl)-3-N-methylpyridine-3,5-diamine
PubChem CID104532337
Molecular FormulaC14H17N3
Molecular Weight227.31 g/mol
Exact Mass227.14
IUPAC Name5-N-(2,4-dimethylphenyl)-3-N-methylpyridine-3,5-diamine
SMILESCNc1cncc(Nc2ccc(C)cc2C)c1
InChIInChI=1S/C14H17N3/c1-10-4-5-14(11(2)6-10)17-13-7-12(15-3)8-16-9-13/h4-9,15,17H,1-3H3
InChIKeyNOADOJDXYPDIGK-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

[5-(2,4-dimethylanilino)-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109225589
5-N-(2-bromophenyl)-3-N-methylpyridine-3,5-diamine
CID 104532356
5-N-(3-fluoro-2-methylphenyl)-3-N-methylpyridine-3,5-diamine
CID 104533871
N-(4-acetylphenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide
CID 109242751
N,2,4-trimethylaniline;hydrochloride
CID 18686602
N-(2,4-dimethylphenyl)-1-methylpyrazol-4-amine
CID 125449684
[5-(2,4-dimethylanilino)-3-pyridinyl]-(4-methylpiperazin-1-yl)methanone
CID 109230137
N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide
CID 109242767
5-N-(4-bromo-2-ethylphenyl)-3-N-methylpyridine-3,5-diamine
CID 104535480
5-N-(2-ethylphenyl)-3-N-methylpyridine-3,5-diamine
CID 104532392
5-N-(2,6-difluoro-3-methylphenyl)-3-N-methylpyridine-3,5-diamine
CID 104535597
4-N-(2,4-dimethylphenyl)-1-N-(3,4-dimethylphenyl)benzene-1,4-diamine
CID 101290973

Frequently Asked Questions

What is the IUPAC name of 5-N-(2,4-dimethylphenyl)-3-N-methylpyridine-3,5-diamine?
The IUPAC name of 5-N-(2,4-dimethylphenyl)-3-N-methylpyridine-3,5-diamine (CID 104532337) is 5-N-(2,4-dimethylphenyl)-3-N-methylpyridine-3,5-diamine.
What is the SMILES notation for 5-N-(2,4-dimethylphenyl)-3-N-methylpyridine-3,5-diamine?
The canonical SMILES for 5-N-(2,4-dimethylphenyl)-3-N-methylpyridine-3,5-diamine is CNc1cncc(Nc2ccc(C)cc2C)c1.
What is the InChIKey of 5-N-(2,4-dimethylphenyl)-3-N-methylpyridine-3,5-diamine?
The InChIKey is NOADOJDXYPDIGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3/c1-10-4-5-14(11(2)6-10)17-13-7-12(15-3)8-16-9-13/h4-9,15,17H,1-3H3.
What are the key properties of 5-N-(2,4-dimethylphenyl)-3-N-methylpyridine-3,5-diamine?
5-N-(2,4-dimethylphenyl)-3-N-methylpyridine-3,5-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 5-N-(2,4-dimethylphenyl)-3-N-methylpyridine-3,5-diamine is sourced from PubChem (CID 104532337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).