1-(1-methylpiperidin-4-yl)-N-(2-piperidin-1-ylethyl)ethanamine

C15H31N3 — CID 54967519

IUPAC1-(1-methylpiperidin-4-yl)-N-(2-piperidin-1-ylethyl)ethanamine
SMILESCC(NCCN1CCCCC1)C1CCN(C)CC1
InChIInChI=1S/C15H31N3/c1-14(15-6-11-17(2)12-7-15)16-8-13-18-9-4-3-5-10-18/h14-16H,3-13H2,1-2H3
InChIKeyMCTVAOQAFOETDH-UHFFFAOYSA-N
MW253.43 g/mol
LogP1.79
Rot. Bonds5

About 1-(1-methylpiperidin-4-yl)-N-(2-piperidin-1-ylethyl)ethanamine

1-(1-methylpiperidin-4-yl)-N-(2-piperidin-1-ylethyl)ethanamine (PubChem CID 54967519) has the molecular formula C15H31N3 and a molecular weight of 253.43 g/mol. Its IUPAC name is 1-(1-methylpiperidin-4-yl)-N-(2-piperidin-1-ylethyl)ethanamine.

Molecular Properties

Compound Name1-(1-methylpiperidin-4-yl)-N-(2-piperidin-1-ylethyl)ethanamine
PubChem CID54967519
Molecular FormulaC15H31N3
Molecular Weight253.43 g/mol
Exact Mass253.25
IUPAC Name1-(1-methylpiperidin-4-yl)-N-(2-piperidin-1-ylethyl)ethanamine
SMILESCC(NCCN1CCCCC1)C1CCN(C)CC1
InChIInChI=1S/C15H31N3/c1-14(15-6-11-17(2)12-7-15)16-8-13-18-9-4-3-5-10-18/h14-16H,3-13H2,1-2H3
InChIKeyMCTVAOQAFOETDH-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

N-[2-(azocan-1-yl)ethyl]-1-cyclopropylethanamine
CID 62574708
N-[2-(azepan-1-yl)ethyl]-1-cyclohexylethanamine
CID 61241929
1-cyclopropyl-N-[2-(4-propan-2-ylpiperidin-1-yl)ethyl]ethanamine
CID 103503465
1-(1-methylpiperidin-3-yl)-N-(2-pyrrolidin-1-ylethyl)ethanamine
CID 43308264
1-(oxolan-3-yl)-N-(2-piperidin-1-ylethyl)ethanamine
CID 115708798
2-methyl-N-[1-(1-methylpiperidin-4-yl)ethyl]-3-pyrrolidin-1-ylpropan-1-amine
CID 62993042
(1S)-1-cycloheptyl-N-(2-morpholin-4-ylethyl)ethanamine
CID 81393168
2-[1-(1-methylpiperidin-4-yl)ethylamino]ethanol
CID 43308736
1-cyclopentyl-N-[2-(4-methylpiperidin-1-yl)ethyl]ethanamine
CID 62631760
1-cyclopropyl-N-[2-(4,4-dimethylazepan-1-yl)ethyl]ethanamine
CID 65286870
1-cyclopropyl-N-[2-(1,4-thiazepan-4-yl)ethyl]ethanamine
CID 62556728
N-[1-(1-methylpiperidin-4-yl)ethyl]-1-pyrrolidin-1-ylpropan-2-amine
CID 54952865

Frequently Asked Questions

What is the IUPAC name of 1-(1-methylpiperidin-4-yl)-N-(2-piperidin-1-ylethyl)ethanamine?
The IUPAC name of 1-(1-methylpiperidin-4-yl)-N-(2-piperidin-1-ylethyl)ethanamine (CID 54967519) is 1-(1-methylpiperidin-4-yl)-N-(2-piperidin-1-ylethyl)ethanamine.
What is the SMILES notation for 1-(1-methylpiperidin-4-yl)-N-(2-piperidin-1-ylethyl)ethanamine?
The canonical SMILES for 1-(1-methylpiperidin-4-yl)-N-(2-piperidin-1-ylethyl)ethanamine is CC(NCCN1CCCCC1)C1CCN(C)CC1.
What is the InChIKey of 1-(1-methylpiperidin-4-yl)-N-(2-piperidin-1-ylethyl)ethanamine?
The InChIKey is MCTVAOQAFOETDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3/c1-14(15-6-11-17(2)12-7-15)16-8-13-18-9-4-3-5-10-18/h14-16H,3-13H2,1-2H3.
What are the key properties of 1-(1-methylpiperidin-4-yl)-N-(2-piperidin-1-ylethyl)ethanamine?
1-(1-methylpiperidin-4-yl)-N-(2-piperidin-1-ylethyl)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 1-(1-methylpiperidin-4-yl)-N-(2-piperidin-1-ylethyl)ethanamine is sourced from PubChem (CID 54967519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).