N-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide

C22H18ClFN2O3 — CID 43041597

IUPACN-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2cccc(OCc3ccc(F)cc3)c2)cc1Cl
InChIInChI=1S/C22H18ClFN2O3/c1-14(27)25-21-10-9-18(12-20(21)23)26-22(28)16-3-2-4-19(11-16)29-13-15-5-7-17(24)8-6-15/h2-12H,13H2,1H3,(H,25,27)(H,26,28)
InChIKeyJRBUIXZMSUAPAB-UHFFFAOYSA-N
MW412.85 g/mol
LogP5.27
Rot. Bonds6

About N-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide

N-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide (PubChem CID 43041597) has the molecular formula C22H18ClFN2O3 and a molecular weight of 412.85 g/mol. Its IUPAC name is N-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide.

Molecular Properties

Compound NameN-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide
PubChem CID43041597
Molecular FormulaC22H18ClFN2O3
Molecular Weight412.85 g/mol
Exact Mass412.10
IUPAC NameN-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide
SMILESCC(=O)Nc1ccc(NC(=O)c2cccc(OCc3ccc(F)cc3)c2)cc1Cl
InChIInChI=1S/C22H18ClFN2O3/c1-14(27)25-21-10-9-18(12-20(21)23)26-22(28)16-3-2-4-19(11-16)29-13-15-5-7-17(24)8-6-15/h2-12H,13H2,1H3,(H,25,27)(H,26,28)
InChIKeyJRBUIXZMSUAPAB-UHFFFAOYSA-N
XLogP5.27
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500412.85
LogP ≤ 55.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]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

N-(3-chloro-4-fluorophenyl)-3-phenylmethoxybenzamide
CID 1074686
N-(3,4-dichlorophenyl)-3-phenylmethoxybenzamide
CID 17148514
N-[4-(2-amino-2-oxoethyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide
CID 31857522
3-cyano-N-[3-[(4-fluorophenyl)methoxy]phenyl]benzamide
CID 46594970
N-[4-(cyclopropylcarbamoyl)phenyl]-3-[(4-fluorophenyl)methoxy]benzamide
CID 46553769
3-[(3,4-dichlorophenyl)methoxy]-N-(4-ethylphenyl)benzamide
CID 8814622
N-(4-acetamido-3-chlorophenyl)-3-bromobenzamide
CID 51321405
3-[(3,4-dichlorophenyl)methoxy]-N-(3-methylphenyl)benzamide
CID 8814570
3-methoxy-N-(3-phenylmethoxyphenyl)benzamide
CID 135564193
N-(4-acetamido-3-chlorophenyl)-3,4-difluorobenzamide
CID 41305249
3-[(4-fluorophenyl)methoxy]-N-(3-methylbutan-2-yl)benzamide
CID 43035024
N-[(3-chloro-4-fluorophenyl)carbamothioyl]-3-phenylmethoxybenzamide
CID 1258743

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide?
The IUPAC name of N-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide (CID 43041597) is N-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide.
What is the SMILES notation for N-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide?
The canonical SMILES for N-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide is CC(=O)Nc1ccc(NC(=O)c2cccc(OCc3ccc(F)cc3)c2)cc1Cl.
What is the InChIKey of N-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide?
The InChIKey is JRBUIXZMSUAPAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18ClFN2O3/c1-14(27)25-21-10-9-18(12-20(21)23)26-22(28)16-3-2-4-19(11-16)29-13-15-5-7-17(24)8-6-15/h2-12H,13H2,1H3,(H,25,27)(H,26,28).
What are the key properties of N-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide?
N-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide has a molecular weight of 412.85 g/mol, XLogP of 5.27, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamido-3-chlorophenyl)-3-[(4-fluorophenyl)methoxy]benzamide is sourced from PubChem (CID 43041597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).