1-[2-(3-ethyl-4-methylpiperazin-1-yl)-4-pyridinyl]-N-methylmethanamine

C14H24N4 — CID 55217767

IUPAC1-[2-(3-ethyl-4-methylpiperazin-1-yl)-4-pyridinyl]-N-methylmethanamine
SMILESCCC1CN(c2cc(CNC)ccn2)CCN1C
InChIInChI=1S/C14H24N4/c1-4-13-11-18(8-7-17(13)3)14-9-12(10-15-2)5-6-16-14/h5-6,9,13,15H,4,7-8,10-11H2,1-3H3
InChIKeyJCUUAVWUDYVMPJ-UHFFFAOYSA-N
MW248.37 g/mol
LogP1.33
Rot. Bonds4

About 1-[2-(3-ethyl-4-methylpiperazin-1-yl)-4-pyridinyl]-N-methylmethanamine

1-[2-(3-ethyl-4-methylpiperazin-1-yl)-4-pyridinyl]-N-methylmethanamine (PubChem CID 55217767) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is 1-[2-(3-ethyl-4-methylpiperazin-1-yl)-4-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(3-ethyl-4-methylpiperazin-1-yl)-4-pyridinyl]-N-methylmethanamine
PubChem CID55217767
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name1-[2-(3-ethyl-4-methylpiperazin-1-yl)-4-pyridinyl]-N-methylmethanamine
SMILESCCC1CN(c2cc(CNC)ccn2)CCN1C
InChIInChI=1S/C14H24N4/c1-4-13-11-18(8-7-17(13)3)14-9-12(10-15-2)5-6-16-14/h5-6,9,13,15H,4,7-8,10-11H2,1-3H3
InChIKeyJCUUAVWUDYVMPJ-UHFFFAOYSA-N
XLogP1.33
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(azocan-1-yl)-4-pyridinyl]-N-methylmethanamine
CID 62280361
1-[2-(2-ethylpiperidin-1-yl)-4-pyridinyl]-N-methylmethanamine
CID 55054433
1-[2-(3-methoxypyrrolidin-1-yl)-4-pyridinyl]-N-methylmethanamine
CID 103539385
1-[6-(3-ethyl-4-methylpiperazin-1-yl)-2-pyridinyl]-N-methylmethanamine
CID 55217768
1-[2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-4-pyridinyl]-N-methylmethanamine
CID 113336197
1-[2-(2-ethyl-5-methylpyrrolidin-1-yl)-4-pyridinyl]-N-methylmethanamine
CID 83221471
4-(3-ethyl-4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 80834207
1-[2-(5-ethyl-2-methylmorpholin-4-yl)-4-pyridinyl]-N-methylmethanamine
CID 55059279
N-methyl-1-[2-(1-oxo-1,4-thiazinan-4-yl)-4-pyridinyl]methanamine
CID 62293701
N-[[2-(4-ethyl-3-methylpiperazin-1-yl)-4-pyridinyl]methyl]ethanamine
CID 63619417
N-methyl-1-[2-(2-methylpyrrolidin-1-yl)-4-pyridinyl]methanamine
CID 62286079
N-[[2-(4-ethyl-3-methylpiperazin-1-yl)-4-pyridinyl]methyl]-2-methylpropan-2-amine
CID 63619592

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-ethyl-4-methylpiperazin-1-yl)-4-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[2-(3-ethyl-4-methylpiperazin-1-yl)-4-pyridinyl]-N-methylmethanamine (CID 55217767) is 1-[2-(3-ethyl-4-methylpiperazin-1-yl)-4-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(3-ethyl-4-methylpiperazin-1-yl)-4-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(3-ethyl-4-methylpiperazin-1-yl)-4-pyridinyl]-N-methylmethanamine is CCC1CN(c2cc(CNC)ccn2)CCN1C.
What is the InChIKey of 1-[2-(3-ethyl-4-methylpiperazin-1-yl)-4-pyridinyl]-N-methylmethanamine?
The InChIKey is JCUUAVWUDYVMPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-4-13-11-18(8-7-17(13)3)14-9-12(10-15-2)5-6-16-14/h5-6,9,13,15H,4,7-8,10-11H2,1-3H3.
What are the key properties of 1-[2-(3-ethyl-4-methylpiperazin-1-yl)-4-pyridinyl]-N-methylmethanamine?
1-[2-(3-ethyl-4-methylpiperazin-1-yl)-4-pyridinyl]-N-methylmethanamine has a molecular weight of 248.37 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-ethyl-4-methylpiperazin-1-yl)-4-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 55217767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).