2-(ethylamino)-1-(1-methylpiperidin-3-yl)ethanone

C10H20N2O — CID 116916675

IUPAC2-(ethylamino)-1-(1-methylpiperidin-3-yl)ethanone
SMILESCCNCC(=O)C1CCCN(C)C1
InChIInChI=1S/C10H20N2O/c1-3-11-7-10(13)9-5-4-6-12(2)8-9/h9,11H,3-8H2,1-2H3
InChIKeySCFNGGGSYQSSDT-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.51
Rot. Bonds4

About 2-(ethylamino)-1-(1-methylpiperidin-3-yl)ethanone

2-(ethylamino)-1-(1-methylpiperidin-3-yl)ethanone (PubChem CID 116916675) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 2-(ethylamino)-1-(1-methylpiperidin-3-yl)ethanone.

Molecular Properties

Compound Name2-(ethylamino)-1-(1-methylpiperidin-3-yl)ethanone
PubChem CID116916675
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name2-(ethylamino)-1-(1-methylpiperidin-3-yl)ethanone
SMILESCCNCC(=O)C1CCCN(C)C1
InChIInChI=1S/C10H20N2O/c1-3-11-7-10(13)9-5-4-6-12(2)8-9/h9,11H,3-8H2,1-2H3
InChIKeySCFNGGGSYQSSDT-UHFFFAOYSA-N
XLogP0.51
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-1-(1-methylpiperidin-3-yl)ethanone?
The IUPAC name of 2-(ethylamino)-1-(1-methylpiperidin-3-yl)ethanone (CID 116916675) is 2-(ethylamino)-1-(1-methylpiperidin-3-yl)ethanone.
What is the SMILES notation for 2-(ethylamino)-1-(1-methylpiperidin-3-yl)ethanone?
The canonical SMILES for 2-(ethylamino)-1-(1-methylpiperidin-3-yl)ethanone is CCNCC(=O)C1CCCN(C)C1.
What is the InChIKey of 2-(ethylamino)-1-(1-methylpiperidin-3-yl)ethanone?
The InChIKey is SCFNGGGSYQSSDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-3-11-7-10(13)9-5-4-6-12(2)8-9/h9,11H,3-8H2,1-2H3.
What are the key properties of 2-(ethylamino)-1-(1-methylpiperidin-3-yl)ethanone?
2-(ethylamino)-1-(1-methylpiperidin-3-yl)ethanone has a molecular weight of 184.28 g/mol, XLogP of 0.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-1-(1-methylpiperidin-3-yl)ethanone is sourced from PubChem (CID 116916675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).