N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-methoxybenzamide

C22H28N2O4 — CID 112503598

IUPACN-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-methoxybenzamide
SMILESCCOc1ccc(C(CNC(=O)c2ccccc2OC)N2CCOCC2)cc1
InChIInChI=1S/C22H28N2O4/c1-3-28-18-10-8-17(9-11-18)20(24-12-14-27-15-13-24)16-23-22(25)19-6-4-5-7-21(19)26-2/h4-11,20H,3,12-16H2,1-2H3,(H,23,25)
InChIKeyMHVXDJXTMLXQRY-UHFFFAOYSA-N
MW384.48 g/mol
LogP2.90
Rot. Bonds8

About N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-methoxybenzamide

N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-methoxybenzamide (PubChem CID 112503598) has the molecular formula C22H28N2O4 and a molecular weight of 384.48 g/mol. Its IUPAC name is N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-methoxybenzamide
PubChem CID112503598
Molecular FormulaC22H28N2O4
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC NameN-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-methoxybenzamide
SMILESCCOc1ccc(C(CNC(=O)c2ccccc2OC)N2CCOCC2)cc1
InChIInChI=1S/C22H28N2O4/c1-3-28-18-10-8-17(9-11-18)20(24-12-14-27-15-13-24)16-23-22(25)19-6-4-5-7-21(19)26-2/h4-11,20H,3,12-16H2,1-2H3,(H,23,25)
InChIKeyMHVXDJXTMLXQRY-UHFFFAOYSA-N
XLogP2.90
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms28
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-methoxybenzamide?
The IUPAC name of N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-methoxybenzamide (CID 112503598) is N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-methoxybenzamide.
What is the SMILES notation for N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-methoxybenzamide?
The canonical SMILES for N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-methoxybenzamide is CCOc1ccc(C(CNC(=O)c2ccccc2OC)N2CCOCC2)cc1.
What is the InChIKey of N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-methoxybenzamide?
The InChIKey is MHVXDJXTMLXQRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O4/c1-3-28-18-10-8-17(9-11-18)20(24-12-14-27-15-13-24)16-23-22(25)19-6-4-5-7-21(19)26-2/h4-11,20H,3,12-16H2,1-2H3,(H,23,25).
What are the key properties of N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-methoxybenzamide?
N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-methoxybenzamide has a molecular weight of 384.48 g/mol, XLogP of 2.90, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethoxyphenyl)-2-morpholin-4-ylethyl]-2-methoxybenzamide is sourced from PubChem (CID 112503598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).