N-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide

C17H13ClN2O3 — CID 110402522

IUPACN-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1oncc1-c1ccc(Cl)cc1
InChIInChI=1S/C17H13ClN2O3/c1-22-15-5-3-2-4-13(15)16(21)20-17-14(10-19-23-17)11-6-8-12(18)9-7-11/h2-10H,1H3,(H,20,21)
InChIKeyJETFKOWUYYWECU-UHFFFAOYSA-N
MW328.76 g/mol
LogP4.26
Rot. Bonds4

About N-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide

N-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide (PubChem CID 110402522) has the molecular formula C17H13ClN2O3 and a molecular weight of 328.76 g/mol. Its IUPAC name is N-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide.

Molecular Properties

Compound NameN-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide
PubChem CID110402522
Molecular FormulaC17H13ClN2O3
Molecular Weight328.76 g/mol
Exact Mass328.06
IUPAC NameN-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1oncc1-c1ccc(Cl)cc1
InChIInChI=1S/C17H13ClN2O3/c1-22-15-5-3-2-4-13(15)16(21)20-17-14(10-19-23-17)11-6-8-12(18)9-7-11/h2-10H,1H3,(H,20,21)
InChIKeyJETFKOWUYYWECU-UHFFFAOYSA-N
XLogP4.26
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.76
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide 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

2,6-dimethoxy-N-(4-phenyl-1,2-oxazol-5-yl)benzamide
CID 110402062
3,4-dimethoxy-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide
CID 110402230
1-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-3-phenylurea
CID 110402542
N-[3-(4-chlorophenyl)-1-methylpyrazol-5-yl]-2-methoxybenzamide
CID 21105221
2-(4-chlorophenoxy)-N-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]acetamide
CID 110402661
N-[6-(4-chloroanilino)pyridazin-3-yl]-2-methoxybenzamide
CID 113047536
1-(4-chlorophenyl)-3-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]urea
CID 110402543
2-(2-methoxyphenoxy)-N-[4-(4-methoxyphenyl)-1,2-oxazol-5-yl]acetamide
CID 110402410
4-methyl-N-[4-(4-methylphenyl)-1,2-oxazol-5-yl]benzamide
CID 110402217
1-(3-chlorophenyl)-3-[4-(3,4-dimethoxyphenyl)-1,2-oxazol-5-yl]urea
CID 110402667
2-methoxy-N-[4-[4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide
CID 3299583
3-(2-methoxyphenyl)-N-[4-(4-methoxyphenyl)-1,2-oxazol-5-yl]propanamide
CID 110402430

Frequently Asked Questions

What is the IUPAC name of N-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide?
The IUPAC name of N-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide (CID 110402522) is N-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide.
What is the SMILES notation for N-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide?
The canonical SMILES for N-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide is COc1ccccc1C(=O)Nc1oncc1-c1ccc(Cl)cc1.
What is the InChIKey of N-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide?
The InChIKey is JETFKOWUYYWECU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13ClN2O3/c1-22-15-5-3-2-4-13(15)16(21)20-17-14(10-19-23-17)11-6-8-12(18)9-7-11/h2-10H,1H3,(H,20,21).
What are the key properties of N-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide?
N-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide has a molecular weight of 328.76 g/mol, XLogP of 4.26, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-chlorophenyl)-1,2-oxazol-5-yl]-2-methoxybenzamide is sourced from PubChem (CID 110402522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).