1-acetyl-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide

C18H25N3O3 — CID 2738203

IUPAC1-acetyl-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)Nc2ccc(N3CCOCC3)cc2)CC1
InChIInChI=1S/C18H25N3O3/c1-14(22)20-8-6-15(7-9-20)18(23)19-16-2-4-17(5-3-16)21-10-12-24-13-11-21/h2-5,15H,6-13H2,1H3,(H,19,23)
InChIKeyRAJPRSBRDBQWDS-UHFFFAOYSA-N
MW331.42 g/mol
LogP1.72
Rot. Bonds3

About 1-acetyl-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide

1-acetyl-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide (PubChem CID 2738203) has the molecular formula C18H25N3O3 and a molecular weight of 331.42 g/mol. Its IUPAC name is 1-acetyl-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-acetyl-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide
PubChem CID2738203
Molecular FormulaC18H25N3O3
Molecular Weight331.42 g/mol
Exact Mass331.19
IUPAC Name1-acetyl-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide
SMILESCC(=O)N1CCC(C(=O)Nc2ccc(N3CCOCC3)cc2)CC1
InChIInChI=1S/C18H25N3O3/c1-14(22)20-8-6-15(7-9-20)18(23)19-16-2-4-17(5-3-16)21-10-12-24-13-11-21/h2-5,15H,6-13H2,1H3,(H,19,23)
InChIKeyRAJPRSBRDBQWDS-UHFFFAOYSA-N
XLogP1.72
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze 1-acetyl-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

4-(4-Aminophenyl)morpholin-3-one
CID 11194854
N-(4-Amino-phenyl)-3-morpholin-4-yl-propionamide
CID 844901
N-(4-((morpholin-4-yl)methyl)phenyl)acetamide
CID 783020
N-[4-(4-morpholinylazo)phenyl]acetamide
CID 799944
1-[2-(2-Morpholinoanilino)-2-oxoethyl]-4-piperidinecarboxamide
CID 2813874
N-[3-(morpholin-4-yl)propyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
CID 6461546
N-(4-morpholin-4-ylphenyl)-3-phenylpropanamide
CID 730073
N-[4-(morpholin-4-yl)phenyl]butanamide
CID 774884
3-morpholin-4-yl-N-phenylpropanamide
CID 2901601
1-(4-Morpholinophenyl)-3-(1-propionylpiperidin-4-yl)urea
CID 49783007
N-(3-methylphenyl)-3-morpholin-4-ylpropanamide
CID 739956
N-[4-(4-methylpiperidin-1-yl)phenyl]propanamide
CID 954514

Frequently Asked Questions

What is the IUPAC name of 1-acetyl-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide?
The IUPAC name of 1-acetyl-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide (CID 2738203) is 1-acetyl-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-acetyl-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide?
The canonical SMILES for 1-acetyl-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide is CC(=O)N1CCC(C(=O)Nc2ccc(N3CCOCC3)cc2)CC1.
What is the InChIKey of 1-acetyl-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide?
The InChIKey is RAJPRSBRDBQWDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O3/c1-14(22)20-8-6-15(7-9-20)18(23)19-16-2-4-17(5-3-16)21-10-12-24-13-11-21/h2-5,15H,6-13H2,1H3,(H,19,23).
What are the key properties of 1-acetyl-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide?
1-acetyl-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide has a molecular weight of 331.42 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-acetyl-N-(4-morpholin-4-ylphenyl)piperidine-4-carboxamide is sourced from PubChem (CID 2738203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).