4-formyl-N-(4-morpholin-2-ylphenyl)benzamide

C18H18N2O3 — CID 86673956

IUPAC4-formyl-N-(4-morpholin-2-ylphenyl)benzamide
SMILESO=Cc1ccc(C(=O)Nc2ccc(C3CNCCO3)cc2)cc1
InChIInChI=1S/C18H18N2O3/c21-12-13-1-3-15(4-2-13)18(22)20-16-7-5-14(6-8-16)17-11-19-9-10-23-17/h1-8,12,17,19H,9-11H2,(H,20,22)
InChIKeyCHVIEWSXVMSYQY-UHFFFAOYSA-N
MW310.35 g/mol
LogP2.41
Rot. Bonds4

About 4-formyl-N-(4-morpholin-2-ylphenyl)benzamide

4-formyl-N-(4-morpholin-2-ylphenyl)benzamide (PubChem CID 86673956) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is 4-formyl-N-(4-morpholin-2-ylphenyl)benzamide.

Molecular Properties

Compound Name4-formyl-N-(4-morpholin-2-ylphenyl)benzamide
PubChem CID86673956
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC Name4-formyl-N-(4-morpholin-2-ylphenyl)benzamide
SMILESO=Cc1ccc(C(=O)Nc2ccc(C3CNCCO3)cc2)cc1
InChIInChI=1S/C18H18N2O3/c21-12-13-1-3-15(4-2-13)18(22)20-16-7-5-14(6-8-16)17-11-19-9-10-23-17/h1-8,12,17,19H,9-11H2,(H,20,22)
InChIKeyCHVIEWSXVMSYQY-UHFFFAOYSA-N
XLogP2.41
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze 4-formyl-N-(4-morpholin-2-ylphenyl)benzamide 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-methoxy-N-(4-morpholin-2-ylphenyl)benzamide;hydrochloride
CID 67239468
4-ethoxy-N-[4-[(2S)-morpholin-2-yl]phenyl]benzamide
CID 67239889
N-(2,6-dichlorophenyl)-4-[(2S)-morpholin-2-yl]benzamide
CID 129387149
2,6-dichloro-N-[4-[(2R)-morpholin-2-yl]phenyl]benzamide
CID 129387150
4-[(2R)-morpholin-2-yl]benzoic acid
CID 96582723
4-chloro-2-methyl-N-[4-[(2S)-morpholin-2-yl]phenyl]benzamide
CID 130184022
methyl 2-chloro-4-[4-[[4-[(2R)-morpholin-2-yl]phenyl]carbamoyl]phenoxy]benzoate
CID 175718206
N-[4-[(2S)-morpholin-2-yl]phenyl]-2-(trifluoromethyl)pyridine-4-carboxamide
CID 56836053
4-chloro-2-fluoro-N-[4-[(2S)-morpholin-2-yl]phenyl]benzamide;4-chloro-2-fluoro-N-[4-[(2R)-morpholin-2-yl]phenyl]benzamide
CID 159688298
tert-butyl N-(4-morpholin-2-ylphenyl)carbamate
CID 117446363
6-fluoro-4-methyl-N-(4-morpholin-2-ylphenyl)-1H-indole-2-carboxamide
CID 167826713
2-(4-fluorophenyl)-N-[4-[(2S)-morpholin-2-yl]phenyl]-3,4-dihydropyrazole-5-carboxamide
CID 71113263

Frequently Asked Questions

What is the IUPAC name of 4-formyl-N-(4-morpholin-2-ylphenyl)benzamide?
The IUPAC name of 4-formyl-N-(4-morpholin-2-ylphenyl)benzamide (CID 86673956) is 4-formyl-N-(4-morpholin-2-ylphenyl)benzamide.
What is the SMILES notation for 4-formyl-N-(4-morpholin-2-ylphenyl)benzamide?
The canonical SMILES for 4-formyl-N-(4-morpholin-2-ylphenyl)benzamide is O=Cc1ccc(C(=O)Nc2ccc(C3CNCCO3)cc2)cc1.
What is the InChIKey of 4-formyl-N-(4-morpholin-2-ylphenyl)benzamide?
The InChIKey is CHVIEWSXVMSYQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c21-12-13-1-3-15(4-2-13)18(22)20-16-7-5-14(6-8-16)17-11-19-9-10-23-17/h1-8,12,17,19H,9-11H2,(H,20,22).
What are the key properties of 4-formyl-N-(4-morpholin-2-ylphenyl)benzamide?
4-formyl-N-(4-morpholin-2-ylphenyl)benzamide has a molecular weight of 310.35 g/mol, XLogP of 2.41, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-formyl-N-(4-morpholin-2-ylphenyl)benzamide is sourced from PubChem (CID 86673956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).