N-(4-ethoxyphenyl)-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]acetamide

C19H28N2O3 — CID 113173923

IUPACN-(4-ethoxyphenyl)-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]acetamide
SMILESCCOc1ccc(N(CC(=O)N2CCCCC2CC)C(C)=O)cc1
InChIInChI=1S/C19H28N2O3/c1-4-16-8-6-7-13-20(16)19(23)14-21(15(3)22)17-9-11-18(12-10-17)24-5-2/h9-12,16H,4-8,13-14H2,1-3H3
InChIKeyDYWGFBBGSCDHDQ-UHFFFAOYSA-N
MW332.44 g/mol
LogP3.23
Rot. Bonds6

About N-(4-ethoxyphenyl)-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]acetamide

N-(4-ethoxyphenyl)-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]acetamide (PubChem CID 113173923) has the molecular formula C19H28N2O3 and a molecular weight of 332.44 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]acetamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]acetamide
PubChem CID113173923
Molecular FormulaC19H28N2O3
Molecular Weight332.44 g/mol
Exact Mass332.21
IUPAC NameN-(4-ethoxyphenyl)-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]acetamide
SMILESCCOc1ccc(N(CC(=O)N2CCCCC2CC)C(C)=O)cc1
InChIInChI=1S/C19H28N2O3/c1-4-16-8-6-7-13-20(16)19(23)14-21(15(3)22)17-9-11-18(12-10-17)24-5-2/h9-12,16H,4-8,13-14H2,1-3H3
InChIKeyDYWGFBBGSCDHDQ-UHFFFAOYSA-N
XLogP3.23
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.44
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]acetamide?
The IUPAC name of N-(4-ethoxyphenyl)-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]acetamide (CID 113173923) is N-(4-ethoxyphenyl)-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]acetamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]acetamide?
The canonical SMILES for N-(4-ethoxyphenyl)-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]acetamide is CCOc1ccc(N(CC(=O)N2CCCCC2CC)C(C)=O)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]acetamide?
The InChIKey is DYWGFBBGSCDHDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O3/c1-4-16-8-6-7-13-20(16)19(23)14-21(15(3)22)17-9-11-18(12-10-17)24-5-2/h9-12,16H,4-8,13-14H2,1-3H3.
What are the key properties of N-(4-ethoxyphenyl)-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]acetamide?
N-(4-ethoxyphenyl)-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]acetamide has a molecular weight of 332.44 g/mol, XLogP of 3.23, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-N-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]acetamide is sourced from PubChem (CID 113173923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).