6-(2,5-dimethylpiperidin-1-yl)pyridine-2,3-diamine

C12H20N4 — CID 79826265

IUPAC6-(2,5-dimethylpiperidin-1-yl)pyridine-2,3-diamine
SMILESCC1CCC(C)N(c2ccc(N)c(N)n2)C1
InChIInChI=1S/C12H20N4/c1-8-3-4-9(2)16(7-8)11-6-5-10(13)12(14)15-11/h5-6,8-9H,3-4,7,13H2,1-2H3,(H2,14,15)
InChIKeyVZFMJSDANHVAHQ-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.87
Rot. Bonds1

About 6-(2,5-dimethylpiperidin-1-yl)pyridine-2,3-diamine

6-(2,5-dimethylpiperidin-1-yl)pyridine-2,3-diamine (PubChem CID 79826265) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 6-(2,5-dimethylpiperidin-1-yl)pyridine-2,3-diamine.

Molecular Properties

Compound Name6-(2,5-dimethylpiperidin-1-yl)pyridine-2,3-diamine
PubChem CID79826265
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name6-(2,5-dimethylpiperidin-1-yl)pyridine-2,3-diamine
SMILESCC1CCC(C)N(c2ccc(N)c(N)n2)C1
InChIInChI=1S/C12H20N4/c1-8-3-4-9(2)16(7-8)11-6-5-10(13)12(14)15-11/h5-6,8-9H,3-4,7,13H2,1-2H3,(H2,14,15)
InChIKeyVZFMJSDANHVAHQ-UHFFFAOYSA-N
XLogP1.87
TPSA68.17 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2,5-dimethylpiperidin-1-yl)pyridine-2,3-diamine?
The IUPAC name of 6-(2,5-dimethylpiperidin-1-yl)pyridine-2,3-diamine (CID 79826265) is 6-(2,5-dimethylpiperidin-1-yl)pyridine-2,3-diamine.
What is the SMILES notation for 6-(2,5-dimethylpiperidin-1-yl)pyridine-2,3-diamine?
The canonical SMILES for 6-(2,5-dimethylpiperidin-1-yl)pyridine-2,3-diamine is CC1CCC(C)N(c2ccc(N)c(N)n2)C1.
What is the InChIKey of 6-(2,5-dimethylpiperidin-1-yl)pyridine-2,3-diamine?
The InChIKey is VZFMJSDANHVAHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-8-3-4-9(2)16(7-8)11-6-5-10(13)12(14)15-11/h5-6,8-9H,3-4,7,13H2,1-2H3,(H2,14,15).
What are the key properties of 6-(2,5-dimethylpiperidin-1-yl)pyridine-2,3-diamine?
6-(2,5-dimethylpiperidin-1-yl)pyridine-2,3-diamine has a molecular weight of 220.32 g/mol, XLogP of 1.87, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-dimethylpiperidin-1-yl)pyridine-2,3-diamine is sourced from PubChem (CID 79826265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).