6-methyl-2-(3,4,5-trimethylpiperazin-1-yl)pyridin-3-amine

C13H22N4 — CID 114543104

IUPAC6-methyl-2-(3,4,5-trimethylpiperazin-1-yl)pyridin-3-amine
SMILESCc1ccc(N)c(N2CC(C)N(C)C(C)C2)n1
InChIInChI=1S/C13H22N4/c1-9-5-6-12(14)13(15-9)17-7-10(2)16(4)11(3)8-17/h5-6,10-11H,7-8,14H2,1-4H3
InChIKeyZOJPZZJBDDPVAY-UHFFFAOYSA-N
MW234.35 g/mol
LogP1.50
Rot. Bonds1

About 6-methyl-2-(3,4,5-trimethylpiperazin-1-yl)pyridin-3-amine

6-methyl-2-(3,4,5-trimethylpiperazin-1-yl)pyridin-3-amine (PubChem CID 114543104) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 6-methyl-2-(3,4,5-trimethylpiperazin-1-yl)pyridin-3-amine.

Molecular Properties

Compound Name6-methyl-2-(3,4,5-trimethylpiperazin-1-yl)pyridin-3-amine
PubChem CID114543104
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name6-methyl-2-(3,4,5-trimethylpiperazin-1-yl)pyridin-3-amine
SMILESCc1ccc(N)c(N2CC(C)N(C)C(C)C2)n1
InChIInChI=1S/C13H22N4/c1-9-5-6-12(14)13(15-9)17-7-10(2)16(4)11(3)8-17/h5-6,10-11H,7-8,14H2,1-4H3
InChIKeyZOJPZZJBDDPVAY-UHFFFAOYSA-N
XLogP1.50
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-(3,4,5-trimethylpiperazin-1-yl)pyridin-3-amine?
The IUPAC name of 6-methyl-2-(3,4,5-trimethylpiperazin-1-yl)pyridin-3-amine (CID 114543104) is 6-methyl-2-(3,4,5-trimethylpiperazin-1-yl)pyridin-3-amine.
What is the SMILES notation for 6-methyl-2-(3,4,5-trimethylpiperazin-1-yl)pyridin-3-amine?
The canonical SMILES for 6-methyl-2-(3,4,5-trimethylpiperazin-1-yl)pyridin-3-amine is Cc1ccc(N)c(N2CC(C)N(C)C(C)C2)n1.
What is the InChIKey of 6-methyl-2-(3,4,5-trimethylpiperazin-1-yl)pyridin-3-amine?
The InChIKey is ZOJPZZJBDDPVAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-9-5-6-12(14)13(15-9)17-7-10(2)16(4)11(3)8-17/h5-6,10-11H,7-8,14H2,1-4H3.
What are the key properties of 6-methyl-2-(3,4,5-trimethylpiperazin-1-yl)pyridin-3-amine?
6-methyl-2-(3,4,5-trimethylpiperazin-1-yl)pyridin-3-amine has a molecular weight of 234.35 g/mol, XLogP of 1.50, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-(3,4,5-trimethylpiperazin-1-yl)pyridin-3-amine is sourced from PubChem (CID 114543104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).