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

C14H17N3O2 — CID 66280389

IUPAC2-N-(2,4-dimethoxyphenyl)-5-methylpyridine-2,3-diamine
SMILESCOc1ccc(Nc2ncc(C)cc2N)c(OC)c1
InChIInChI=1S/C14H17N3O2/c1-9-6-11(15)14(16-8-9)17-12-5-4-10(18-2)7-13(12)19-3/h4-8H,15H2,1-3H3,(H,16,17)
InChIKeyMSHIGLGKKYVYAA-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.73
Rot. Bonds4

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

2-N-(2,4-dimethoxyphenyl)-5-methylpyridine-2,3-diamine (PubChem CID 66280389) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-N-(2,4-dimethoxyphenyl)-5-methylpyridine-2,3-diamine.

Molecular Properties

Compound Name2-N-(2,4-dimethoxyphenyl)-5-methylpyridine-2,3-diamine
PubChem CID66280389
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name2-N-(2,4-dimethoxyphenyl)-5-methylpyridine-2,3-diamine
SMILESCOc1ccc(Nc2ncc(C)cc2N)c(OC)c1
InChIInChI=1S/C14H17N3O2/c1-9-6-11(15)14(16-8-9)17-12-5-4-10(18-2)7-13(12)19-3/h4-8H,15H2,1-3H3,(H,16,17)
InChIKeyMSHIGLGKKYVYAA-UHFFFAOYSA-N
XLogP2.73
TPSA69.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-N,6-N-bis(2,4-dimethoxyphenyl)pyrimidine-4,5,6-triamine
CID 19142820
4-N-(2,4-dimethoxyphenyl)-6-(4-methylphenyl)sulfanylpyrimidine-4,5-diamine
CID 19142877
6-N-(2,3-dichlorophenyl)-4-N-(2,4-dimethoxyphenyl)pyrimidine-4,5,6-triamine
CID 19142849
3-bromo-5-chloro-N-(2,4-dimethoxyphenyl)pyridin-2-amine
CID 114836602
6-N-[(2-chlorophenyl)methyl]-4-N-(2,4-dimethoxyphenyl)pyrimidine-4,5,6-triamine
CID 19142949
5-methyl-2-N-(2-propoxyphenyl)pyridine-2,3-diamine
CID 82059608
5-amino-6-(2,5-dimethoxyanilino)pyridine-3-carboxylic acid
CID 81447017
4-N-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-6-N-(2,4-dimethoxyphenyl)pyrimidine-4,5,6-triamine
CID 19142964
N-(2,4-dimethoxyphenyl)-5-ethyl-6-hydrazinylpyrimidin-4-amine
CID 80913595
2-N-(2,3-dimethylphenyl)-5-methylpyridine-2,3-diamine
CID 66280393
6-(4-bromophenoxy)-4-N-(2,4-dimethoxyphenyl)pyrimidine-4,5-diamine
CID 19142963
6-N-(2,4-dimethoxyphenyl)-4-N-methyl-4-N-phenylpyrimidine-4,5,6-triamine
CID 19142831

Frequently Asked Questions

What is the IUPAC name of 2-N-(2,4-dimethoxyphenyl)-5-methylpyridine-2,3-diamine?
The IUPAC name of 2-N-(2,4-dimethoxyphenyl)-5-methylpyridine-2,3-diamine (CID 66280389) is 2-N-(2,4-dimethoxyphenyl)-5-methylpyridine-2,3-diamine.
What is the SMILES notation for 2-N-(2,4-dimethoxyphenyl)-5-methylpyridine-2,3-diamine?
The canonical SMILES for 2-N-(2,4-dimethoxyphenyl)-5-methylpyridine-2,3-diamine is COc1ccc(Nc2ncc(C)cc2N)c(OC)c1.
What is the InChIKey of 2-N-(2,4-dimethoxyphenyl)-5-methylpyridine-2,3-diamine?
The InChIKey is MSHIGLGKKYVYAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-9-6-11(15)14(16-8-9)17-12-5-4-10(18-2)7-13(12)19-3/h4-8H,15H2,1-3H3,(H,16,17).
What are the key properties of 2-N-(2,4-dimethoxyphenyl)-5-methylpyridine-2,3-diamine?
2-N-(2,4-dimethoxyphenyl)-5-methylpyridine-2,3-diamine has a molecular weight of 259.31 g/mol, XLogP of 2.73, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2,4-dimethoxyphenyl)-5-methylpyridine-2,3-diamine is sourced from PubChem (CID 66280389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).