1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine

C13H22N4 — CID 63621802

IUPAC1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine
SMILESCNCc1cccc(N2CCN(C)C(C)C2)n1
InChIInChI=1S/C13H22N4/c1-11-10-17(8-7-16(11)3)13-6-4-5-12(15-13)9-14-2/h4-6,11,14H,7-10H2,1-3H3
InChIKeyRJAUHCRWIYFGDT-UHFFFAOYSA-N
MW234.35 g/mol
LogP0.94
Rot. Bonds3

About 1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine

1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine (PubChem CID 63621802) has the molecular formula C13H22N4 and a molecular weight of 234.35 g/mol. Its IUPAC name is 1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine
PubChem CID63621802
Molecular FormulaC13H22N4
Molecular Weight234.35 g/mol
Exact Mass234.18
IUPAC Name1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine
SMILESCNCc1cccc(N2CCN(C)C(C)C2)n1
InChIInChI=1S/C13H22N4/c1-11-10-17(8-7-16(11)3)13-6-4-5-12(15-13)9-14-2/h4-6,11,14H,7-10H2,1-3H3
InChIKeyRJAUHCRWIYFGDT-UHFFFAOYSA-N
XLogP0.94
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine (CID 63621802) is 1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine is CNCc1cccc(N2CCN(C)C(C)C2)n1.
What is the InChIKey of 1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine?
The InChIKey is RJAUHCRWIYFGDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4/c1-11-10-17(8-7-16(11)3)13-6-4-5-12(15-13)9-14-2/h4-6,11,14H,7-10H2,1-3H3.
What are the key properties of 1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine?
1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine has a molecular weight of 234.35 g/mol, XLogP of 0.94, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(3,4-dimethylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 63621802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).