1-[2-(ethylamino)ethyl]piperidin-2-one

C9H18N2O — CID 61387338

IUPAC1-[2-(ethylamino)ethyl]piperidin-2-one
SMILESCCNCCN1CCCCC1=O
InChIInChI=1S/C9H18N2O/c1-2-10-6-8-11-7-4-3-5-9(11)12/h10H,2-8H2,1H3
InChIKeyHJTPOBGGUMSUGH-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.61
Rot. Bonds4

About 1-[2-(ethylamino)ethyl]piperidin-2-one

1-[2-(ethylamino)ethyl]piperidin-2-one (PubChem CID 61387338) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 1-[2-(ethylamino)ethyl]piperidin-2-one.

Molecular Properties

Compound Name1-[2-(ethylamino)ethyl]piperidin-2-one
PubChem CID61387338
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name1-[2-(ethylamino)ethyl]piperidin-2-one
SMILESCCNCCN1CCCCC1=O
InChIInChI=1S/C9H18N2O/c1-2-10-6-8-11-7-4-3-5-9(11)12/h10H,2-8H2,1H3
InChIKeyHJTPOBGGUMSUGH-UHFFFAOYSA-N
XLogP0.61
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-[2-(ethylamino)ethyl]azocan-2-one
CID 61386984
1-[2-(tert-butylamino)ethyl]azepan-2-one
CID 61387620
acetaldehyde;ethane;1-[2-(methylamino)ethyl]piperidin-2-one
CID 169185862
1-[2-[3-[2-(2-oxopyrrolidin-1-yl)ethylamino]propylamino]ethyl]pyrrolidin-2-one
CID 19837416
N-[2-(2-oxopiperidin-1-yl)ethyl]propanamide
CID 110722707
1-[3-(propan-2-ylamino)propyl]azepan-2-one
CID 60695423
1-[2-[2-(4-methylpyrazol-1-yl)ethylamino]ethyl]pyrrolidin-2-one
CID 56780234
1-(3,3-dimethylbutyl)azepan-2-one
CID 15031641
1-[(2-oxoazepan-1-yl)methyl]azepan-2-one
CID 11746692
N-[2-(2-oxopiperidin-1-yl)ethyl]-2,2-diphenylacetamide
CID 110722740
1-[2-(propylamino)butyl]piperidin-2-one
CID 62040592
1-(2-difluoroboranylethyl)piperidin-2-one
CID 123234744

Frequently Asked Questions

What is the IUPAC name of 1-[2-(ethylamino)ethyl]piperidin-2-one?
The IUPAC name of 1-[2-(ethylamino)ethyl]piperidin-2-one (CID 61387338) is 1-[2-(ethylamino)ethyl]piperidin-2-one.
What is the SMILES notation for 1-[2-(ethylamino)ethyl]piperidin-2-one?
The canonical SMILES for 1-[2-(ethylamino)ethyl]piperidin-2-one is CCNCCN1CCCCC1=O.
What is the InChIKey of 1-[2-(ethylamino)ethyl]piperidin-2-one?
The InChIKey is HJTPOBGGUMSUGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-2-10-6-8-11-7-4-3-5-9(11)12/h10H,2-8H2,1H3.
What are the key properties of 1-[2-(ethylamino)ethyl]piperidin-2-one?
1-[2-(ethylamino)ethyl]piperidin-2-one has a molecular weight of 170.26 g/mol, XLogP of 0.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(ethylamino)ethyl]piperidin-2-one is sourced from PubChem (CID 61387338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).