[2-(2-aminoethyl)piperidin-1-yl]-cyclohexylmethanone

C14H26N2O — CID 63755194

IUPAC[2-(2-aminoethyl)piperidin-1-yl]-cyclohexylmethanone
SMILESNCCC1CCCCN1C(=O)C1CCCCC1
InChIInChI=1S/C14H26N2O/c15-10-9-13-8-4-5-11-16(13)14(17)12-6-2-1-3-7-12/h12-13H,1-11,15H2
InChIKeyADCVESQRMDHRHD-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.30
Rot. Bonds3

About [2-(2-aminoethyl)piperidin-1-yl]-cyclohexylmethanone

[2-(2-aminoethyl)piperidin-1-yl]-cyclohexylmethanone (PubChem CID 63755194) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is [2-(2-aminoethyl)piperidin-1-yl]-cyclohexylmethanone.

Molecular Properties

Compound Name[2-(2-aminoethyl)piperidin-1-yl]-cyclohexylmethanone
PubChem CID63755194
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name[2-(2-aminoethyl)piperidin-1-yl]-cyclohexylmethanone
SMILESNCCC1CCCCN1C(=O)C1CCCCC1
InChIInChI=1S/C14H26N2O/c15-10-9-13-8-4-5-11-16(13)14(17)12-6-2-1-3-7-12/h12-13H,1-11,15H2
InChIKeyADCVESQRMDHRHD-UHFFFAOYSA-N
XLogP2.30
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(aminomethyl)pyrrolidin-1-yl]-cyclohexylmethanone;hydrochloride
CID 119261191
[2-(chloromethyl)piperidin-1-yl]-cyclohexylmethanone
CID 63395604
cyclopentyl-[2-(hydroxymethyl)azepan-1-yl]methanone
CID 116636172
cyclooctyl-[2-[2-(methylamino)ethyl]piperidin-1-yl]methanone
CID 65023261
cyclohexyl-[(2R)-2-ethylpiperidin-1-yl]methanone
CID 798108
[2-(bromomethyl)piperidin-1-yl]-cyclooctylmethanone
CID 80660817
[2-(2-aminoethyl)piperidin-1-yl]-(thian-2-yl)methanone
CID 80596527
[3-(2-aminoethyl)cyclohexyl]-(2-ethylazepan-1-yl)methanone
CID 104692568
5-[2-(2-aminoethyl)piperidine-1-carbonyl]piperidin-2-one
CID 83192038
1-[2-(2-aminoethyl)piperidin-1-yl]-2-methylpropan-1-one
CID 63755741
[2-(3-bromopropyl)pyrrolidin-1-yl]-cyclopentylmethanone
CID 80676795
1-[2-(2-aminoethyl)piperidin-1-yl]-2,2-difluoroethanone
CID 103840913

Frequently Asked Questions

What is the IUPAC name of [2-(2-aminoethyl)piperidin-1-yl]-cyclohexylmethanone?
The IUPAC name of [2-(2-aminoethyl)piperidin-1-yl]-cyclohexylmethanone (CID 63755194) is [2-(2-aminoethyl)piperidin-1-yl]-cyclohexylmethanone.
What is the SMILES notation for [2-(2-aminoethyl)piperidin-1-yl]-cyclohexylmethanone?
The canonical SMILES for [2-(2-aminoethyl)piperidin-1-yl]-cyclohexylmethanone is NCCC1CCCCN1C(=O)C1CCCCC1.
What is the InChIKey of [2-(2-aminoethyl)piperidin-1-yl]-cyclohexylmethanone?
The InChIKey is ADCVESQRMDHRHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c15-10-9-13-8-4-5-11-16(13)14(17)12-6-2-1-3-7-12/h12-13H,1-11,15H2.
What are the key properties of [2-(2-aminoethyl)piperidin-1-yl]-cyclohexylmethanone?
[2-(2-aminoethyl)piperidin-1-yl]-cyclohexylmethanone has a molecular weight of 238.37 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-aminoethyl)piperidin-1-yl]-cyclohexylmethanone is sourced from PubChem (CID 63755194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).