(4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone

C16H30N2O2 — CID 66256554

IUPAC(4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone
SMILESCCCNC1COCC1C(=O)N1CCC(C)(CC)CC1
InChIInChI=1S/C16H30N2O2/c1-4-8-17-14-12-20-11-13(14)15(19)18-9-6-16(3,5-2)7-10-18/h13-14,17H,4-12H2,1-3H3
InChIKeyARXHETVPNCGPNY-UHFFFAOYSA-N
MW282.43 g/mol
LogP2.04
Rot. Bonds5

About (4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone

(4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone (PubChem CID 66256554) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is (4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone.

Molecular Properties

Compound Name(4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone
PubChem CID66256554
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC Name(4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone
SMILESCCCNC1COCC1C(=O)N1CCC(C)(CC)CC1
InChIInChI=1S/C16H30N2O2/c1-4-8-17-14-12-20-11-13(14)15(19)18-9-6-16(3,5-2)7-10-18/h13-14,17H,4-12H2,1-3H3
InChIKeyARXHETVPNCGPNY-UHFFFAOYSA-N
XLogP2.04
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone?
The IUPAC name of (4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone (CID 66256554) is (4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone.
What is the SMILES notation for (4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone?
The canonical SMILES for (4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone is CCCNC1COCC1C(=O)N1CCC(C)(CC)CC1.
What is the InChIKey of (4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone?
The InChIKey is ARXHETVPNCGPNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-4-8-17-14-12-20-11-13(14)15(19)18-9-6-16(3,5-2)7-10-18/h13-14,17H,4-12H2,1-3H3.
What are the key properties of (4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone?
(4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone has a molecular weight of 282.43 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethyl-4-methylpiperidin-1-yl)-[4-(propylamino)oxolan-3-yl]methanone is sourced from PubChem (CID 66256554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).