2-(3-ethoxycyclobutyl)-1-[4-(ethylamino)piperidin-1-yl]ethanone

C15H28N2O2 — CID 103161304

IUPAC2-(3-ethoxycyclobutyl)-1-[4-(ethylamino)piperidin-1-yl]ethanone
SMILESCCNC1CCN(C(=O)CC2CC(OCC)C2)CC1
InChIInChI=1S/C15H28N2O2/c1-3-16-13-5-7-17(8-6-13)15(18)11-12-9-14(10-12)19-4-2/h12-14,16H,3-11H2,1-2H3
InChIKeyORUZYSWAYNOCHU-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.79
Rot. Bonds6

About 2-(3-ethoxycyclobutyl)-1-[4-(ethylamino)piperidin-1-yl]ethanone

2-(3-ethoxycyclobutyl)-1-[4-(ethylamino)piperidin-1-yl]ethanone (PubChem CID 103161304) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-(3-ethoxycyclobutyl)-1-[4-(ethylamino)piperidin-1-yl]ethanone.

Molecular Properties

Compound Name2-(3-ethoxycyclobutyl)-1-[4-(ethylamino)piperidin-1-yl]ethanone
PubChem CID103161304
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name2-(3-ethoxycyclobutyl)-1-[4-(ethylamino)piperidin-1-yl]ethanone
SMILESCCNC1CCN(C(=O)CC2CC(OCC)C2)CC1
InChIInChI=1S/C15H28N2O2/c1-3-16-13-5-7-17(8-6-13)15(18)11-12-9-14(10-12)19-4-2/h12-14,16H,3-11H2,1-2H3
InChIKeyORUZYSWAYNOCHU-UHFFFAOYSA-N
XLogP1.79
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxycyclobutyl)-1-[4-(ethylamino)piperidin-1-yl]ethanone?
The IUPAC name of 2-(3-ethoxycyclobutyl)-1-[4-(ethylamino)piperidin-1-yl]ethanone (CID 103161304) is 2-(3-ethoxycyclobutyl)-1-[4-(ethylamino)piperidin-1-yl]ethanone.
What is the SMILES notation for 2-(3-ethoxycyclobutyl)-1-[4-(ethylamino)piperidin-1-yl]ethanone?
The canonical SMILES for 2-(3-ethoxycyclobutyl)-1-[4-(ethylamino)piperidin-1-yl]ethanone is CCNC1CCN(C(=O)CC2CC(OCC)C2)CC1.
What is the InChIKey of 2-(3-ethoxycyclobutyl)-1-[4-(ethylamino)piperidin-1-yl]ethanone?
The InChIKey is ORUZYSWAYNOCHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-3-16-13-5-7-17(8-6-13)15(18)11-12-9-14(10-12)19-4-2/h12-14,16H,3-11H2,1-2H3.
What are the key properties of 2-(3-ethoxycyclobutyl)-1-[4-(ethylamino)piperidin-1-yl]ethanone?
2-(3-ethoxycyclobutyl)-1-[4-(ethylamino)piperidin-1-yl]ethanone has a molecular weight of 268.40 g/mol, XLogP of 1.79, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxycyclobutyl)-1-[4-(ethylamino)piperidin-1-yl]ethanone is sourced from PubChem (CID 103161304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).