1-(2-ethylpiperidin-1-yl)-2-(oxolan-2-ylmethylamino)ethanone

C14H26N2O2 — CID 3229573

IUPAC1-(2-ethylpiperidin-1-yl)-2-(oxolan-2-ylmethylamino)ethanone
SMILESCCC1CCCCN1C(=O)CNCC1CCCO1
InChIInChI=1S/C14H26N2O2/c1-2-12-6-3-4-8-16(12)14(17)11-15-10-13-7-5-9-18-13/h12-13,15H,2-11H2,1H3
InChIKeyDQBYUQAIMHCDPL-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.55
Rot. Bonds5

About 1-(2-ethylpiperidin-1-yl)-2-(oxolan-2-ylmethylamino)ethanone

1-(2-ethylpiperidin-1-yl)-2-(oxolan-2-ylmethylamino)ethanone (PubChem CID 3229573) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is 1-(2-ethylpiperidin-1-yl)-2-(oxolan-2-ylmethylamino)ethanone.

Molecular Properties

Compound Name1-(2-ethylpiperidin-1-yl)-2-(oxolan-2-ylmethylamino)ethanone
PubChem CID3229573
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Name1-(2-ethylpiperidin-1-yl)-2-(oxolan-2-ylmethylamino)ethanone
SMILESCCC1CCCCN1C(=O)CNCC1CCCO1
InChIInChI=1S/C14H26N2O2/c1-2-12-6-3-4-8-16(12)14(17)11-15-10-13-7-5-9-18-13/h12-13,15H,2-11H2,1H3
InChIKeyDQBYUQAIMHCDPL-UHFFFAOYSA-N
XLogP1.55
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylpiperidin-1-yl)-2-(oxolan-2-ylmethylamino)ethanone?
The IUPAC name of 1-(2-ethylpiperidin-1-yl)-2-(oxolan-2-ylmethylamino)ethanone (CID 3229573) is 1-(2-ethylpiperidin-1-yl)-2-(oxolan-2-ylmethylamino)ethanone.
What is the SMILES notation for 1-(2-ethylpiperidin-1-yl)-2-(oxolan-2-ylmethylamino)ethanone?
The canonical SMILES for 1-(2-ethylpiperidin-1-yl)-2-(oxolan-2-ylmethylamino)ethanone is CCC1CCCCN1C(=O)CNCC1CCCO1.
What is the InChIKey of 1-(2-ethylpiperidin-1-yl)-2-(oxolan-2-ylmethylamino)ethanone?
The InChIKey is DQBYUQAIMHCDPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-2-12-6-3-4-8-16(12)14(17)11-15-10-13-7-5-9-18-13/h12-13,15H,2-11H2,1H3.
What are the key properties of 1-(2-ethylpiperidin-1-yl)-2-(oxolan-2-ylmethylamino)ethanone?
1-(2-ethylpiperidin-1-yl)-2-(oxolan-2-ylmethylamino)ethanone has a molecular weight of 254.37 g/mol, XLogP of 1.55, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylpiperidin-1-yl)-2-(oxolan-2-ylmethylamino)ethanone is sourced from PubChem (CID 3229573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).