3-(ethylamino)-1-(4-hydroxypiperidin-1-yl)propan-1-one

C10H20N2O2 — CID 62831735

IUPAC3-(ethylamino)-1-(4-hydroxypiperidin-1-yl)propan-1-one
SMILESCCNCCC(=O)N1CCC(O)CC1
InChIInChI=1S/C10H20N2O2/c1-2-11-6-3-10(14)12-7-4-9(13)5-8-12/h9,11,13H,2-8H2,1H3
InChIKeyYSKHMYFMMITEKG-UHFFFAOYSA-N
MW200.28 g/mol
LogP-0.03
Rot. Bonds4

About 3-(ethylamino)-1-(4-hydroxypiperidin-1-yl)propan-1-one

3-(ethylamino)-1-(4-hydroxypiperidin-1-yl)propan-1-one (PubChem CID 62831735) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 3-(ethylamino)-1-(4-hydroxypiperidin-1-yl)propan-1-one.

Molecular Properties

Compound Name3-(ethylamino)-1-(4-hydroxypiperidin-1-yl)propan-1-one
PubChem CID62831735
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name3-(ethylamino)-1-(4-hydroxypiperidin-1-yl)propan-1-one
SMILESCCNCCC(=O)N1CCC(O)CC1
InChIInChI=1S/C10H20N2O2/c1-2-11-6-3-10(14)12-7-4-9(13)5-8-12/h9,11,13H,2-8H2,1H3
InChIKeyYSKHMYFMMITEKG-UHFFFAOYSA-N
XLogP-0.03
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[1-[3-(ethylamino)propanoyl]piperidin-4-yl]butanamide
CID 62835122
1-[3-(ethylamino)propanoyl]-N-(3-hydroxypropyl)piperidine-4-carboxamide
CID 62835714
ethane;1-(4-hydroxypiperidin-1-yl)propan-1-one
CID 145216334
3-(tert-butylamino)-1-[(3S)-3-hydroxypyrrolidin-1-yl]propan-1-one
CID 94896146
N-ethyl-2-[4-[3-(ethylamino)propanoyl]piperazin-1-yl]acetamide
CID 62834367
3-(ethylamino)-1-[4-(4-fluorophenyl)piperazin-1-yl]propan-1-one
CID 62832473
3-(ethylamino)-1-(4-propylsulfonylpiperazin-1-yl)propan-1-one
CID 55121142
3-(ethylamino)-1-(3-hydroxy-3-propan-2-ylazetidin-1-yl)propan-1-one
CID 107220129
3-(ethylamino)-N-[1-(2-methoxyacetyl)piperidin-4-yl]propanamide
CID 62833950
N-[2-(4-hydroxypiperidin-1-yl)-2-oxoethyl]formamide
CID 142971251
3-(ethylamino)-1-(4-phenylpiperazin-1-yl)propan-1-one
CID 62831183
1-(2,6-dimethylpiperidin-1-yl)-3-(ethylamino)propan-1-one
CID 62833376

Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-1-(4-hydroxypiperidin-1-yl)propan-1-one?
The IUPAC name of 3-(ethylamino)-1-(4-hydroxypiperidin-1-yl)propan-1-one (CID 62831735) is 3-(ethylamino)-1-(4-hydroxypiperidin-1-yl)propan-1-one.
What is the SMILES notation for 3-(ethylamino)-1-(4-hydroxypiperidin-1-yl)propan-1-one?
The canonical SMILES for 3-(ethylamino)-1-(4-hydroxypiperidin-1-yl)propan-1-one is CCNCCC(=O)N1CCC(O)CC1.
What is the InChIKey of 3-(ethylamino)-1-(4-hydroxypiperidin-1-yl)propan-1-one?
The InChIKey is YSKHMYFMMITEKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-2-11-6-3-10(14)12-7-4-9(13)5-8-12/h9,11,13H,2-8H2,1H3.
What are the key properties of 3-(ethylamino)-1-(4-hydroxypiperidin-1-yl)propan-1-one?
3-(ethylamino)-1-(4-hydroxypiperidin-1-yl)propan-1-one has a molecular weight of 200.28 g/mol, XLogP of -0.03, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-1-(4-hydroxypiperidin-1-yl)propan-1-one is sourced from PubChem (CID 62831735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).