3,4-dimethylpyridine-2,6-diamine

C7H11N3 — CID 23049439

IUPAC3,4-dimethylpyridine-2,6-diamine
SMILESCc1cc(N)nc(N)c1C
InChIInChI=1S/C7H11N3/c1-4-3-6(8)10-7(9)5(4)2/h3H,1-2H3,(H4,8,9,10)
InChIKeyLWHVWLRDWAZQIS-UHFFFAOYSA-N
MW137.19 g/mol
LogP0.86
Rot. Bonds

About 3,4-dimethylpyridine-2,6-diamine

3,4-dimethylpyridine-2,6-diamine (PubChem CID 23049439) has the molecular formula C7H11N3 and a molecular weight of 137.19 g/mol. Its IUPAC name is 3,4-dimethylpyridine-2,6-diamine.

Molecular Properties

Compound Name3,4-dimethylpyridine-2,6-diamine
PubChem CID23049439
Molecular FormulaC7H11N3
Molecular Weight137.19 g/mol
Exact Mass137.10
IUPAC Name3,4-dimethylpyridine-2,6-diamine
SMILESCc1cc(N)nc(N)c1C
InChIInChI=1S/C7H11N3/c1-4-3-6(8)10-7(9)5(4)2/h3H,1-2H3,(H4,8,9,10)
InChIKeyLWHVWLRDWAZQIS-UHFFFAOYSA-N
XLogP0.86
TPSA64.93 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.19
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethylpyridine-2,6-diamine?
The IUPAC name of 3,4-dimethylpyridine-2,6-diamine (CID 23049439) is 3,4-dimethylpyridine-2,6-diamine.
What is the SMILES notation for 3,4-dimethylpyridine-2,6-diamine?
The canonical SMILES for 3,4-dimethylpyridine-2,6-diamine is Cc1cc(N)nc(N)c1C.
What is the InChIKey of 3,4-dimethylpyridine-2,6-diamine?
The InChIKey is LWHVWLRDWAZQIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3/c1-4-3-6(8)10-7(9)5(4)2/h3H,1-2H3,(H4,8,9,10).
What are the key properties of 3,4-dimethylpyridine-2,6-diamine?
3,4-dimethylpyridine-2,6-diamine has a molecular weight of 137.19 g/mol, XLogP of 0.86, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethylpyridine-2,6-diamine is sourced from PubChem (CID 23049439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).