2,6-dimethylpyridine-3,4,5-triamine

C7H12N4 — CID 21436310

IUPAC2,6-dimethylpyridine-3,4,5-triamine
SMILESCc1nc(C)c(N)c(N)c1N
InChIInChI=1S/C7H12N4/c1-3-5(8)7(10)6(9)4(2)11-3/h8-9H2,1-2H3,(H2,10,11)
InChIKeyQYASRLYTRJRUCZ-UHFFFAOYSA-N
MW152.20 g/mol
LogP0.45
Rot. Bonds

About 2,6-dimethylpyridine-3,4,5-triamine

2,6-dimethylpyridine-3,4,5-triamine (PubChem CID 21436310) has the molecular formula C7H12N4 and a molecular weight of 152.20 g/mol. Its IUPAC name is 2,6-dimethylpyridine-3,4,5-triamine.

Molecular Properties

Compound Name2,6-dimethylpyridine-3,4,5-triamine
PubChem CID21436310
Molecular FormulaC7H12N4
Molecular Weight152.20 g/mol
Exact Mass152.11
IUPAC Name2,6-dimethylpyridine-3,4,5-triamine
SMILESCc1nc(C)c(N)c(N)c1N
InChIInChI=1S/C7H12N4/c1-3-5(8)7(10)6(9)4(2)11-3/h8-9H2,1-2H3,(H2,10,11)
InChIKeyQYASRLYTRJRUCZ-UHFFFAOYSA-N
XLogP0.45
TPSA90.95 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 50.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethylpyridine-3,4,5-triamine?
The IUPAC name of 2,6-dimethylpyridine-3,4,5-triamine (CID 21436310) is 2,6-dimethylpyridine-3,4,5-triamine.
What is the SMILES notation for 2,6-dimethylpyridine-3,4,5-triamine?
The canonical SMILES for 2,6-dimethylpyridine-3,4,5-triamine is Cc1nc(C)c(N)c(N)c1N.
What is the InChIKey of 2,6-dimethylpyridine-3,4,5-triamine?
The InChIKey is QYASRLYTRJRUCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4/c1-3-5(8)7(10)6(9)4(2)11-3/h8-9H2,1-2H3,(H2,10,11).
What are the key properties of 2,6-dimethylpyridine-3,4,5-triamine?
2,6-dimethylpyridine-3,4,5-triamine has a molecular weight of 152.20 g/mol, XLogP of 0.45, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethylpyridine-3,4,5-triamine is sourced from PubChem (CID 21436310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).