2-(4-chlorophenyl)-N-[4-(3-methylmorpholine-4-carbonyl)phenyl]acetamide

C20H21ClN2O3 — CID 110352615

IUPAC2-(4-chlorophenyl)-N-[4-(3-methylmorpholine-4-carbonyl)phenyl]acetamide
SMILESCC1COCCN1C(=O)c1ccc(NC(=O)Cc2ccc(Cl)cc2)cc1
InChIInChI=1S/C20H21ClN2O3/c1-14-13-26-11-10-23(14)20(25)16-4-8-18(9-5-16)22-19(24)12-15-2-6-17(21)7-3-15/h2-9,14H,10-13H2,1H3,(H,22,24)
InChIKeyKAVUQTRBDDTWCP-UHFFFAOYSA-N
MW372.85 g/mol
LogP3.38
Rot. Bonds4

About 2-(4-chlorophenyl)-N-[4-(3-methylmorpholine-4-carbonyl)phenyl]acetamide

2-(4-chlorophenyl)-N-[4-(3-methylmorpholine-4-carbonyl)phenyl]acetamide (PubChem CID 110352615) has the molecular formula C20H21ClN2O3 and a molecular weight of 372.85 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-[4-(3-methylmorpholine-4-carbonyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-[4-(3-methylmorpholine-4-carbonyl)phenyl]acetamide
PubChem CID110352615
Molecular FormulaC20H21ClN2O3
Molecular Weight372.85 g/mol
Exact Mass372.12
IUPAC Name2-(4-chlorophenyl)-N-[4-(3-methylmorpholine-4-carbonyl)phenyl]acetamide
SMILESCC1COCCN1C(=O)c1ccc(NC(=O)Cc2ccc(Cl)cc2)cc1
InChIInChI=1S/C20H21ClN2O3/c1-14-13-26-11-10-23(14)20(25)16-4-8-18(9-5-16)22-19(24)12-15-2-6-17(21)7-3-15/h2-9,14H,10-13H2,1H3,(H,22,24)
InChIKeyKAVUQTRBDDTWCP-UHFFFAOYSA-N
XLogP3.38
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.85
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-chlorophenyl)-N-[4-(3-methylmorpholine-4-carbonyl)phenyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-[4-(3-methylmorpholine-4-carbonyl)phenyl]acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-[4-(3-methylmorpholine-4-carbonyl)phenyl]acetamide (CID 110352615) is 2-(4-chlorophenyl)-N-[4-(3-methylmorpholine-4-carbonyl)phenyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-[4-(3-methylmorpholine-4-carbonyl)phenyl]acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-[4-(3-methylmorpholine-4-carbonyl)phenyl]acetamide is CC1COCCN1C(=O)c1ccc(NC(=O)Cc2ccc(Cl)cc2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-[4-(3-methylmorpholine-4-carbonyl)phenyl]acetamide?
The InChIKey is KAVUQTRBDDTWCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21ClN2O3/c1-14-13-26-11-10-23(14)20(25)16-4-8-18(9-5-16)22-19(24)12-15-2-6-17(21)7-3-15/h2-9,14H,10-13H2,1H3,(H,22,24).
What are the key properties of 2-(4-chlorophenyl)-N-[4-(3-methylmorpholine-4-carbonyl)phenyl]acetamide?
2-(4-chlorophenyl)-N-[4-(3-methylmorpholine-4-carbonyl)phenyl]acetamide has a molecular weight of 372.85 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-[4-(3-methylmorpholine-4-carbonyl)phenyl]acetamide is sourced from PubChem (CID 110352615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).