1-(3-amino-4-ethylpiperidin-1-yl)-2-methoxyethanone

C10H20N2O2 — CID 165440680

IUPAC1-(3-amino-4-ethylpiperidin-1-yl)-2-methoxyethanone
SMILESCCC1CCN(C(=O)COC)CC1N
InChIInChI=1S/C10H20N2O2/c1-3-8-4-5-12(6-9(8)11)10(13)7-14-2/h8-9H,3-7,11H2,1-2H3
InChIKeyNWKIBVRECADCTJ-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.22
Rot. Bonds3

About 1-(3-amino-4-ethylpiperidin-1-yl)-2-methoxyethanone

1-(3-amino-4-ethylpiperidin-1-yl)-2-methoxyethanone (PubChem CID 165440680) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 1-(3-amino-4-ethylpiperidin-1-yl)-2-methoxyethanone.

Molecular Properties

Compound Name1-(3-amino-4-ethylpiperidin-1-yl)-2-methoxyethanone
PubChem CID165440680
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name1-(3-amino-4-ethylpiperidin-1-yl)-2-methoxyethanone
SMILESCCC1CCN(C(=O)COC)CC1N
InChIInChI=1S/C10H20N2O2/c1-3-8-4-5-12(6-9(8)11)10(13)7-14-2/h8-9H,3-7,11H2,1-2H3
InChIKeyNWKIBVRECADCTJ-UHFFFAOYSA-N
XLogP0.22
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-amino-4-ethylpiperidin-1-yl)-2-methoxyethanone?
The IUPAC name of 1-(3-amino-4-ethylpiperidin-1-yl)-2-methoxyethanone (CID 165440680) is 1-(3-amino-4-ethylpiperidin-1-yl)-2-methoxyethanone.
What is the SMILES notation for 1-(3-amino-4-ethylpiperidin-1-yl)-2-methoxyethanone?
The canonical SMILES for 1-(3-amino-4-ethylpiperidin-1-yl)-2-methoxyethanone is CCC1CCN(C(=O)COC)CC1N.
What is the InChIKey of 1-(3-amino-4-ethylpiperidin-1-yl)-2-methoxyethanone?
The InChIKey is NWKIBVRECADCTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-3-8-4-5-12(6-9(8)11)10(13)7-14-2/h8-9H,3-7,11H2,1-2H3.
What are the key properties of 1-(3-amino-4-ethylpiperidin-1-yl)-2-methoxyethanone?
1-(3-amino-4-ethylpiperidin-1-yl)-2-methoxyethanone has a molecular weight of 200.28 g/mol, XLogP of 0.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-amino-4-ethylpiperidin-1-yl)-2-methoxyethanone is sourced from PubChem (CID 165440680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).