2-(3,4-dimethoxyphenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide

C21H24N2O5 — CID 991553

IUPAC2-(3,4-dimethoxyphenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide
SMILESCOc1ccc(CC(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1OC
InChIInChI=1S/C21H24N2O5/c1-26-18-8-7-15(13-19(18)27-2)14-20(24)22-17-6-4-3-5-16(17)21(25)23-9-11-28-12-10-23/h3-8,13H,9-12,14H2,1-2H3,(H,22,24)
InChIKeyYACOEIITPCXCGD-UHFFFAOYSA-N
MW384.43 g/mol
LogP2.36
Rot. Bonds6

About 2-(3,4-dimethoxyphenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide

2-(3,4-dimethoxyphenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide (PubChem CID 991553) has the molecular formula C21H24N2O5 and a molecular weight of 384.43 g/mol. Its IUPAC name is 2-(3,4-dimethoxyphenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(3,4-dimethoxyphenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide
PubChem CID991553
Molecular FormulaC21H24N2O5
Molecular Weight384.43 g/mol
Exact Mass384.17
IUPAC Name2-(3,4-dimethoxyphenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide
SMILESCOc1ccc(CC(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1OC
InChIInChI=1S/C21H24N2O5/c1-26-18-8-7-15(13-19(18)27-2)14-20(24)22-17-6-4-3-5-16(17)21(25)23-9-11-28-12-10-23/h3-8,13H,9-12,14H2,1-2H3,(H,22,24)
InChIKeyYACOEIITPCXCGD-UHFFFAOYSA-N
XLogP2.36
TPSA77.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.43
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethoxyphenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide?
The IUPAC name of 2-(3,4-dimethoxyphenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide (CID 991553) is 2-(3,4-dimethoxyphenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide.
What is the SMILES notation for 2-(3,4-dimethoxyphenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide?
The canonical SMILES for 2-(3,4-dimethoxyphenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide is COc1ccc(CC(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1OC.
What is the InChIKey of 2-(3,4-dimethoxyphenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide?
The InChIKey is YACOEIITPCXCGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24N2O5/c1-26-18-8-7-15(13-19(18)27-2)14-20(24)22-17-6-4-3-5-16(17)21(25)23-9-11-28-12-10-23/h3-8,13H,9-12,14H2,1-2H3,(H,22,24).
What are the key properties of 2-(3,4-dimethoxyphenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide?
2-(3,4-dimethoxyphenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide has a molecular weight of 384.43 g/mol, XLogP of 2.36, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethoxyphenyl)-N-[2-(morpholine-4-carbonyl)phenyl]acetamide is sourced from PubChem (CID 991553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).