N-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide

C22H24N2O3 — CID 110612773

IUPACN-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide
SMILESO=C(Cc1ccc(N2CCOCC2)cc1)Nc1ccc(C(=O)C2CC2)cc1
InChIInChI=1S/C22H24N2O3/c25-21(23-19-7-5-18(6-8-19)22(26)17-3-4-17)15-16-1-9-20(10-2-16)24-11-13-27-14-12-24/h1-2,5-10,17H,3-4,11-15H2,(H,23,25)
InChIKeyGEWJVTNRJKFEGC-UHFFFAOYSA-N
MW364.45 g/mol
LogP3.30
Rot. Bonds6

About N-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide

N-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide (PubChem CID 110612773) has the molecular formula C22H24N2O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is N-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound NameN-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide
PubChem CID110612773
Molecular FormulaC22H24N2O3
Molecular Weight364.45 g/mol
Exact Mass364.18
IUPAC NameN-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide
SMILESO=C(Cc1ccc(N2CCOCC2)cc1)Nc1ccc(C(=O)C2CC2)cc1
InChIInChI=1S/C22H24N2O3/c25-21(23-19-7-5-18(6-8-19)22(26)17-3-4-17)15-16-1-9-20(10-2-16)24-11-13-27-14-12-24/h1-2,5-10,17H,3-4,11-15H2,(H,23,25)
InChIKeyGEWJVTNRJKFEGC-UHFFFAOYSA-N
XLogP3.30
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide?
The IUPAC name of N-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide (CID 110612773) is N-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for N-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for N-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide is O=C(Cc1ccc(N2CCOCC2)cc1)Nc1ccc(C(=O)C2CC2)cc1.
What is the InChIKey of N-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide?
The InChIKey is GEWJVTNRJKFEGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3/c25-21(23-19-7-5-18(6-8-19)22(26)17-3-4-17)15-16-1-9-20(10-2-16)24-11-13-27-14-12-24/h1-2,5-10,17H,3-4,11-15H2,(H,23,25).
What are the key properties of N-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide?
N-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide has a molecular weight of 364.45 g/mol, XLogP of 3.30, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(cyclopropanecarbonyl)phenyl]-2-(4-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 110612773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).