2-ethoxy-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide

C17H24N2O3 — CID 2105640

IUPAC2-ethoxy-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide
SMILESCCOc1ccccc1C(=O)NCC(=O)N1CCC(C)CC1
InChIInChI=1S/C17H24N2O3/c1-3-22-15-7-5-4-6-14(15)17(21)18-12-16(20)19-10-8-13(2)9-11-19/h4-7,13H,3,8-12H2,1-2H3,(H,18,21)
InChIKeyKTBYUWLDJZVOJP-UHFFFAOYSA-N
MW304.39 g/mol
LogP2.07
Rot. Bonds5

About 2-ethoxy-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide

2-ethoxy-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide (PubChem CID 2105640) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-ethoxy-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2-ethoxy-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide
PubChem CID2105640
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name2-ethoxy-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide
SMILESCCOc1ccccc1C(=O)NCC(=O)N1CCC(C)CC1
InChIInChI=1S/C17H24N2O3/c1-3-22-15-7-5-4-6-14(15)17(21)18-12-16(20)19-10-8-13(2)9-11-19/h4-7,13H,3,8-12H2,1-2H3,(H,18,21)
InChIKeyKTBYUWLDJZVOJP-UHFFFAOYSA-N
XLogP2.07
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide?
The IUPAC name of 2-ethoxy-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide (CID 2105640) is 2-ethoxy-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide.
What is the SMILES notation for 2-ethoxy-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide?
The canonical SMILES for 2-ethoxy-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide is CCOc1ccccc1C(=O)NCC(=O)N1CCC(C)CC1.
What is the InChIKey of 2-ethoxy-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide?
The InChIKey is KTBYUWLDJZVOJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-3-22-15-7-5-4-6-14(15)17(21)18-12-16(20)19-10-8-13(2)9-11-19/h4-7,13H,3,8-12H2,1-2H3,(H,18,21).
What are the key properties of 2-ethoxy-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide?
2-ethoxy-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide has a molecular weight of 304.39 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]benzamide is sourced from PubChem (CID 2105640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).