2-(2-chlorophenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide

C20H21ClN2O4 — CID 4932099

IUPAC2-(2-chlorophenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide
SMILESCC(Oc1ccccc1Cl)C(=O)Nc1ccccc1C(=O)N1CCOCC1
InChIInChI=1S/C20H21ClN2O4/c1-14(27-18-9-5-3-7-16(18)21)19(24)22-17-8-4-2-6-15(17)20(25)23-10-12-26-13-11-23/h2-9,14H,10-13H2,1H3,(H,22,24)
InChIKeyDGSDCMSYWASQOK-UHFFFAOYSA-N
MW388.85 g/mol
LogP3.22
Rot. Bonds5

About 2-(2-chlorophenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide

2-(2-chlorophenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide (PubChem CID 4932099) has the molecular formula C20H21ClN2O4 and a molecular weight of 388.85 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide
PubChem CID4932099
Molecular FormulaC20H21ClN2O4
Molecular Weight388.85 g/mol
Exact Mass388.12
IUPAC Name2-(2-chlorophenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide
SMILESCC(Oc1ccccc1Cl)C(=O)Nc1ccccc1C(=O)N1CCOCC1
InChIInChI=1S/C20H21ClN2O4/c1-14(27-18-9-5-3-7-16(18)21)19(24)22-17-8-4-2-6-15(17)20(25)23-10-12-26-13-11-23/h2-9,14H,10-13H2,1H3,(H,22,24)
InChIKeyDGSDCMSYWASQOK-UHFFFAOYSA-N
XLogP3.22
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.85
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide?
The IUPAC name of 2-(2-chlorophenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide (CID 4932099) is 2-(2-chlorophenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide.
What is the SMILES notation for 2-(2-chlorophenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide?
The canonical SMILES for 2-(2-chlorophenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide is CC(Oc1ccccc1Cl)C(=O)Nc1ccccc1C(=O)N1CCOCC1.
What is the InChIKey of 2-(2-chlorophenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide?
The InChIKey is DGSDCMSYWASQOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21ClN2O4/c1-14(27-18-9-5-3-7-16(18)21)19(24)22-17-8-4-2-6-15(17)20(25)23-10-12-26-13-11-23/h2-9,14H,10-13H2,1H3,(H,22,24).
What are the key properties of 2-(2-chlorophenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide?
2-(2-chlorophenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide has a molecular weight of 388.85 g/mol, XLogP of 3.22, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-N-[2-(morpholine-4-carbonyl)phenyl]propanamide is sourced from PubChem (CID 4932099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).