N-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine

C14H24N4 — CID 115239455

IUPACN-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine
SMILESCN(CCC1CN(C)CCN1)Cc1cccnc1
InChIInChI=1S/C14H24N4/c1-17(11-13-4-3-6-15-10-13)8-5-14-12-18(2)9-7-16-14/h3-4,6,10,14,16H,5,7-9,11-12H2,1-2H3
InChIKeyWHYIEFNPPGVSPM-UHFFFAOYSA-N
MW248.37 g/mol
LogP0.81
Rot. Bonds5

About N-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine

N-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine (PubChem CID 115239455) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is N-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine
PubChem CID115239455
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC NameN-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine
SMILESCN(CCC1CN(C)CCN1)Cc1cccnc1
InChIInChI=1S/C14H24N4/c1-17(11-13-4-3-6-15-10-13)8-5-14-12-18(2)9-7-16-14/h3-4,6,10,14,16H,5,7-9,11-12H2,1-2H3
InChIKeyWHYIEFNPPGVSPM-UHFFFAOYSA-N
XLogP0.81
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-N-[2-(4-methylpiperazin-2-yl)ethyl]pyridin-3-amine
CID 115239388
2-(4-methylpiperazin-2-yl)-N-(2-pyridin-3-ylethyl)ethanamine
CID 115239483
N-methyl-N-[(5-methylfuran-2-yl)methyl]-2-(4-methylpiperazin-2-yl)ethanamine
CID 115239457
2-(4-methylpiperazin-2-yl)-1-pyridin-3-ylethanone
CID 116920038
N-methyl-2-piperidin-2-yl-N-(2-pyridin-3-ylethyl)ethanamine
CID 115211208
1-methyl-3-(2-phenylethyl)piperazine
CID 82470032
N-methyl-N-(pyridin-3-ylmethyl)-1-thiomorpholin-3-ylmethanamine
CID 82916326
N-methyl-2-morpholin-3-yl-N-(2-pyridin-3-ylethyl)ethanamine
CID 115239048
2-methyl-N-[(4-methylpiperazin-2-yl)methyl]-2-pyridin-3-ylpropan-1-amine
CID 115238821
2-[2-[methyl(pyridin-3-ylmethyl)amino]ethyl]cyclopentan-1-amine
CID 79569163
N-[(3-bromophenyl)methyl]-N-methyl-1-(4-methylpiperazin-2-yl)methanamine
CID 115238727
(6S)-1-methyl-4-[2-[methyl(pyridin-3-ylmethyl)amino]acetyl]-1,4-diazepane-6-carboxamide
CID 124992362

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine?
The IUPAC name of N-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine (CID 115239455) is N-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine.
What is the SMILES notation for N-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine?
The canonical SMILES for N-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine is CN(CCC1CN(C)CCN1)Cc1cccnc1.
What is the InChIKey of N-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine?
The InChIKey is WHYIEFNPPGVSPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-17(11-13-4-3-6-15-10-13)8-5-14-12-18(2)9-7-16-14/h3-4,6,10,14,16H,5,7-9,11-12H2,1-2H3.
What are the key properties of N-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine?
N-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine has a molecular weight of 248.37 g/mol, XLogP of 0.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(4-methylpiperazin-2-yl)-N-(pyridin-3-ylmethyl)ethanamine is sourced from PubChem (CID 115239455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).