2-(1,4-dimethylpiperazin-2-yl)-1-(5-methyl-3-pyridinyl)ethanamine

C14H24N4 — CID 113305498

IUPAC2-(1,4-dimethylpiperazin-2-yl)-1-(5-methyl-3-pyridinyl)ethanamine
SMILESCc1cncc(C(N)CC2CN(C)CCN2C)c1
InChIInChI=1S/C14H24N4/c1-11-6-12(9-16-8-11)14(15)7-13-10-17(2)4-5-18(13)3/h6,8-9,13-14H,4-5,7,10,15H2,1-3H3
InChIKeyYBCHDMNTAUFWHN-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.03
Rot. Bonds3

About 2-(1,4-dimethylpiperazin-2-yl)-1-(5-methyl-3-pyridinyl)ethanamine

2-(1,4-dimethylpiperazin-2-yl)-1-(5-methyl-3-pyridinyl)ethanamine (PubChem CID 113305498) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 2-(1,4-dimethylpiperazin-2-yl)-1-(5-methyl-3-pyridinyl)ethanamine.

Molecular Properties

Compound Name2-(1,4-dimethylpiperazin-2-yl)-1-(5-methyl-3-pyridinyl)ethanamine
PubChem CID113305498
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name2-(1,4-dimethylpiperazin-2-yl)-1-(5-methyl-3-pyridinyl)ethanamine
SMILESCc1cncc(C(N)CC2CN(C)CCN2C)c1
InChIInChI=1S/C14H24N4/c1-11-6-12(9-16-8-11)14(15)7-13-10-17(2)4-5-18(13)3/h6,8-9,13-14H,4-5,7,10,15H2,1-3H3
InChIKeyYBCHDMNTAUFWHN-UHFFFAOYSA-N
XLogP1.03
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(1,4-dimethylpiperazin-2-yl)-1-(4-ethylphenyl)ethanamine
CID 115415177
3-[1-amino-2-(1,4-dimethylpiperazin-2-yl)ethyl]pyridin-4-amine
CID 113305502
1-(2-amino-5-methyl-3-pyridinyl)-2-(1,4-dimethylpiperazin-2-yl)ethanol
CID 115414904
[2-(1,4-dimethylpiperazin-2-yl)-1-(3-fluoro-5-methylphenyl)ethyl]hydrazine
CID 105260291
1-(4-cyclobutylphenyl)-2-(1,4-dimethylpiperazin-2-yl)ethanamine
CID 116506406
1-(1,4-dimethylpiperazin-2-yl)propan-2-amine
CID 115415048
2-(1,4-dimethylpiperazin-2-yl)-1-pyridin-3-ylethanol
CID 113305480
1-(4-bromo-1-propan-2-ylpyrazol-5-yl)-2-(1,4-dimethylpiperazin-2-yl)ethanamine
CID 114659608
2-(1,4-dimethylpiperazin-2-yl)-1-(4-methoxy-1-methylpyrazol-5-yl)ethanamine
CID 114659615
1-(4-chloro-1-propylpyrazol-5-yl)-2-(1,4-dimethylpiperazin-2-yl)ethanamine
CID 114659610
2-(1,4-dimethylpiperazin-2-yl)-1-(2-ethoxyphenyl)ethanamine
CID 115415033
1-(5-methyl-3-pyridinyl)hexan-1-amine
CID 105023199

Frequently Asked Questions

What is the IUPAC name of 2-(1,4-dimethylpiperazin-2-yl)-1-(5-methyl-3-pyridinyl)ethanamine?
The IUPAC name of 2-(1,4-dimethylpiperazin-2-yl)-1-(5-methyl-3-pyridinyl)ethanamine (CID 113305498) is 2-(1,4-dimethylpiperazin-2-yl)-1-(5-methyl-3-pyridinyl)ethanamine.
What is the SMILES notation for 2-(1,4-dimethylpiperazin-2-yl)-1-(5-methyl-3-pyridinyl)ethanamine?
The canonical SMILES for 2-(1,4-dimethylpiperazin-2-yl)-1-(5-methyl-3-pyridinyl)ethanamine is Cc1cncc(C(N)CC2CN(C)CCN2C)c1.
What is the InChIKey of 2-(1,4-dimethylpiperazin-2-yl)-1-(5-methyl-3-pyridinyl)ethanamine?
The InChIKey is YBCHDMNTAUFWHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-11-6-12(9-16-8-11)14(15)7-13-10-17(2)4-5-18(13)3/h6,8-9,13-14H,4-5,7,10,15H2,1-3H3.
What are the key properties of 2-(1,4-dimethylpiperazin-2-yl)-1-(5-methyl-3-pyridinyl)ethanamine?
2-(1,4-dimethylpiperazin-2-yl)-1-(5-methyl-3-pyridinyl)ethanamine has a molecular weight of 248.37 g/mol, XLogP of 1.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,4-dimethylpiperazin-2-yl)-1-(5-methyl-3-pyridinyl)ethanamine is sourced from PubChem (CID 113305498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).