N-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine

C15H31N3 — CID 115209441

IUPACN-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine
SMILESCN1CCCC(CCN(C)CC2CCCCN2)C1
InChIInChI=1S/C15H31N3/c1-17-10-5-6-14(12-17)8-11-18(2)13-15-7-3-4-9-16-15/h14-16H,3-13H2,1-2H3
InChIKeyLWCCRWHKMICNED-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.79
Rot. Bonds5

About N-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine

N-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine (PubChem CID 115209441) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is N-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine
PubChem CID115209441
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC NameN-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine
SMILESCN1CCCC(CCN(C)CC2CCCCN2)C1
InChIInChI=1S/C15H31N3/c1-17-10-5-6-14(12-17)8-11-18(2)13-15-7-3-4-9-16-15/h14-16H,3-13H2,1-2H3
InChIKeyLWCCRWHKMICNED-UHFFFAOYSA-N
XLogP1.79
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclohexyl-N-methyl-N-[(4-methylpiperazin-2-yl)methyl]ethanamine
CID 115238803
N-methyl-N-(piperidin-2-ylmethyl)-2-pyrrolidin-1-ylethanamine
CID 63207373
[methyl-[2-(1-methylpiperidin-3-yl)ethyl]amino]methanol
CID 115229573
N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-1-piperidin-2-ylmethanamine
CID 79314836
1-cyclopentyl-N-methyl-N-(pyrrolidin-2-ylmethyl)methanamine
CID 63631590
2-(1-methylpiperidin-3-yl)-N-(pyrrolidin-2-ylmethyl)ethanamine
CID 115208430
1-N,2-dimethyl-1-N-[2-(1-methylpiperidin-3-yl)ethyl]propane-1,2-diamine
CID 115136320
1-methyl-3-[(1-methylpiperidin-3-yl)methyl]piperazine
CID 116928178
3-[methyl(piperidin-2-ylmethyl)amino]propanoic acid
CID 106635493
4-[methyl(piperidin-2-ylmethyl)amino]butan-1-ol
CID 106635214
N-methyl-N-[2-(1-methylpiperidin-3-yl)ethyl]propan-2-amine
CID 117044255
N-methyl-2-(1-methylimidazol-2-yl)-N-(piperidin-2-ylmethyl)ethanamine
CID 106635225

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine?
The IUPAC name of N-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine (CID 115209441) is N-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine.
What is the SMILES notation for N-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine?
The canonical SMILES for N-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine is CN1CCCC(CCN(C)CC2CCCCN2)C1.
What is the InChIKey of N-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine?
The InChIKey is LWCCRWHKMICNED-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-17-10-5-6-14(12-17)8-11-18(2)13-15-7-3-4-9-16-15/h14-16H,3-13H2,1-2H3.
What are the key properties of N-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine?
N-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine has a molecular weight of 253.43 g/mol, XLogP of 1.79, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(1-methylpiperidin-3-yl)-N-(piperidin-2-ylmethyl)ethanamine is sourced from PubChem (CID 115209441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).