2-N-(2-methoxy-5-methylphenyl)-6-methylpyridine-2,3-diamine

C14H17N3O — CID 81131819

IUPAC2-N-(2-methoxy-5-methylphenyl)-6-methylpyridine-2,3-diamine
SMILESCOc1ccc(C)cc1Nc1nc(C)ccc1N
InChIInChI=1S/C14H17N3O/c1-9-4-7-13(18-3)12(8-9)17-14-11(15)6-5-10(2)16-14/h4-8H,15H2,1-3H3,(H,16,17)
InChIKeyMTYJZNIDYGDFRD-UHFFFAOYSA-N
MW243.31 g/mol
LogP3.03
Rot. Bonds3

About 2-N-(2-methoxy-5-methylphenyl)-6-methylpyridine-2,3-diamine

2-N-(2-methoxy-5-methylphenyl)-6-methylpyridine-2,3-diamine (PubChem CID 81131819) has the molecular formula C14H17N3O and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-N-(2-methoxy-5-methylphenyl)-6-methylpyridine-2,3-diamine.

Molecular Properties

Compound Name2-N-(2-methoxy-5-methylphenyl)-6-methylpyridine-2,3-diamine
PubChem CID81131819
Molecular FormulaC14H17N3O
Molecular Weight243.31 g/mol
Exact Mass243.14
IUPAC Name2-N-(2-methoxy-5-methylphenyl)-6-methylpyridine-2,3-diamine
SMILESCOc1ccc(C)cc1Nc1nc(C)ccc1N
InChIInChI=1S/C14H17N3O/c1-9-4-7-13(18-3)12(8-9)17-14-11(15)6-5-10(2)16-14/h4-8H,15H2,1-3H3,(H,16,17)
InChIKeyMTYJZNIDYGDFRD-UHFFFAOYSA-N
XLogP3.03
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-(5-methoxy-2-methylphenyl)-6-methylpyridine-2,3-diamine
CID 114252576
2-N-(2,5-dimethoxyphenyl)-6-methoxypyridine-2,3-diamine
CID 115320342
3,5-dichloro-6-hydrazinyl-N-(2-methoxy-5-methylphenyl)pyridin-2-amine
CID 102762320
1-N-(2-methoxy-5-methylphenyl)naphthalene-1,2-diamine
CID 57231048
6-N-(2,4-dichlorophenyl)-4-N-(2-methoxy-5-methylphenyl)pyrimidine-4,5,6-triamine
CID 22541920
8-N-(2-methoxy-5-methylphenyl)quinoline-5,8-diamine
CID 43450177
2-N-(2-methoxy-4,5-dimethylphenyl)-4-methylbenzene-1,2-diamine
CID 115126204
1-N-(2-methoxy-5-methylphenyl)-4-methylbenzene-1,3-diamine
CID 62912994
4-N-(4,5-dimethyl-1,3-thiazol-2-yl)-6-N-(2-methoxy-5-methylphenyl)pyrimidine-4,5,6-triamine
CID 22541918
6-N-(2,3-dimethylphenyl)-4-N-(2-methoxy-5-methylphenyl)pyrimidine-4,5,6-triamine
CID 22541866
2-chloro-4-N-(2-methoxy-5-methylphenyl)-5-methylbenzene-1,4-diamine
CID 115554504
5-amino-6-(5-bromo-2-methoxyanilino)pyridine-2-carboxylic acid
CID 114405965

Frequently Asked Questions

What is the IUPAC name of 2-N-(2-methoxy-5-methylphenyl)-6-methylpyridine-2,3-diamine?
The IUPAC name of 2-N-(2-methoxy-5-methylphenyl)-6-methylpyridine-2,3-diamine (CID 81131819) is 2-N-(2-methoxy-5-methylphenyl)-6-methylpyridine-2,3-diamine.
What is the SMILES notation for 2-N-(2-methoxy-5-methylphenyl)-6-methylpyridine-2,3-diamine?
The canonical SMILES for 2-N-(2-methoxy-5-methylphenyl)-6-methylpyridine-2,3-diamine is COc1ccc(C)cc1Nc1nc(C)ccc1N.
What is the InChIKey of 2-N-(2-methoxy-5-methylphenyl)-6-methylpyridine-2,3-diamine?
The InChIKey is MTYJZNIDYGDFRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O/c1-9-4-7-13(18-3)12(8-9)17-14-11(15)6-5-10(2)16-14/h4-8H,15H2,1-3H3,(H,16,17).
What are the key properties of 2-N-(2-methoxy-5-methylphenyl)-6-methylpyridine-2,3-diamine?
2-N-(2-methoxy-5-methylphenyl)-6-methylpyridine-2,3-diamine has a molecular weight of 243.31 g/mol, XLogP of 3.03, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-methoxy-5-methylphenyl)-6-methylpyridine-2,3-diamine is sourced from PubChem (CID 81131819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).