5-[(3,5-dimethylpiperazin-1-yl)methyl]-N-ethyl-N-methylpyridin-2-amine

C15H26N4 — CID 120840096

IUPAC5-[(3,5-dimethylpiperazin-1-yl)methyl]-N-ethyl-N-methylpyridin-2-amine
SMILESCCN(C)c1ccc(CN2CC(C)NC(C)C2)cn1
InChIInChI=1S/C15H26N4/c1-5-18(4)15-7-6-14(8-16-15)11-19-9-12(2)17-13(3)10-19/h6-8,12-13,17H,5,9-11H2,1-4H3
InChIKeyKNZHRSYOWKABRD-UHFFFAOYSA-N
MW262.40 g/mol
LogP1.72
Rot. Bonds4

About 5-[(3,5-dimethylpiperazin-1-yl)methyl]-N-ethyl-N-methylpyridin-2-amine

5-[(3,5-dimethylpiperazin-1-yl)methyl]-N-ethyl-N-methylpyridin-2-amine (PubChem CID 120840096) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 5-[(3,5-dimethylpiperazin-1-yl)methyl]-N-ethyl-N-methylpyridin-2-amine.

Molecular Properties

Compound Name5-[(3,5-dimethylpiperazin-1-yl)methyl]-N-ethyl-N-methylpyridin-2-amine
PubChem CID120840096
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name5-[(3,5-dimethylpiperazin-1-yl)methyl]-N-ethyl-N-methylpyridin-2-amine
SMILESCCN(C)c1ccc(CN2CC(C)NC(C)C2)cn1
InChIInChI=1S/C15H26N4/c1-5-18(4)15-7-6-14(8-16-15)11-19-9-12(2)17-13(3)10-19/h6-8,12-13,17H,5,9-11H2,1-4H3
InChIKeyKNZHRSYOWKABRD-UHFFFAOYSA-N
XLogP1.72
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-[(3,5-dimethylpiperazin-1-yl)methyl]-N-ethyl-N-methylpyridin-2-amine?
The IUPAC name of 5-[(3,5-dimethylpiperazin-1-yl)methyl]-N-ethyl-N-methylpyridin-2-amine (CID 120840096) is 5-[(3,5-dimethylpiperazin-1-yl)methyl]-N-ethyl-N-methylpyridin-2-amine.
What is the SMILES notation for 5-[(3,5-dimethylpiperazin-1-yl)methyl]-N-ethyl-N-methylpyridin-2-amine?
The canonical SMILES for 5-[(3,5-dimethylpiperazin-1-yl)methyl]-N-ethyl-N-methylpyridin-2-amine is CCN(C)c1ccc(CN2CC(C)NC(C)C2)cn1.
What is the InChIKey of 5-[(3,5-dimethylpiperazin-1-yl)methyl]-N-ethyl-N-methylpyridin-2-amine?
The InChIKey is KNZHRSYOWKABRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-5-18(4)15-7-6-14(8-16-15)11-19-9-12(2)17-13(3)10-19/h6-8,12-13,17H,5,9-11H2,1-4H3.
What are the key properties of 5-[(3,5-dimethylpiperazin-1-yl)methyl]-N-ethyl-N-methylpyridin-2-amine?
5-[(3,5-dimethylpiperazin-1-yl)methyl]-N-ethyl-N-methylpyridin-2-amine has a molecular weight of 262.40 g/mol, XLogP of 1.72, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3,5-dimethylpiperazin-1-yl)methyl]-N-ethyl-N-methylpyridin-2-amine is sourced from PubChem (CID 120840096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).