2-chloro-N-methyl-5-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]benzamide

C24H18ClN3O3 — CID 55836034

IUPAC2-chloro-N-methyl-5-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]benzamide
SMILESCNC(=O)c1cc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)ccc1Cl
InChIInChI=1S/C24H18ClN3O3/c1-26-22(29)19-13-16(11-12-20(19)25)28-23(30)17-9-5-6-10-18(17)24-27-14-21(31-24)15-7-3-2-4-8-15/h2-14H,1H3,(H,26,29)(H,28,30)
InChIKeyOFPMVPUBFMYIBM-UHFFFAOYSA-N
MW431.88 g/mol
LogP5.27
Rot. Bonds5

About 2-chloro-N-methyl-5-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]benzamide

2-chloro-N-methyl-5-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]benzamide (PubChem CID 55836034) has the molecular formula C24H18ClN3O3 and a molecular weight of 431.88 g/mol. Its IUPAC name is 2-chloro-N-methyl-5-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]benzamide.

Molecular Properties

Compound Name2-chloro-N-methyl-5-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]benzamide
PubChem CID55836034
Molecular FormulaC24H18ClN3O3
Molecular Weight431.88 g/mol
Exact Mass431.10
IUPAC Name2-chloro-N-methyl-5-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]benzamide
SMILESCNC(=O)c1cc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)ccc1Cl
InChIInChI=1S/C24H18ClN3O3/c1-26-22(29)19-13-16(11-12-20(19)25)28-23(30)17-9-5-6-10-18(17)24-27-14-21(31-24)15-7-3-2-4-8-15/h2-14H,1H3,(H,26,29)(H,28,30)
InChIKeyOFPMVPUBFMYIBM-UHFFFAOYSA-N
XLogP5.27
TPSA84.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500431.88
LogP ≤ 55.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-chloro-4-cyanophenyl)-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
CID 9456205
2-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]-N-(3,4-dimethylphenyl)benzamide
CID 100512790
N-[4-fluoro-3-(methanesulfonamido)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
CID 24659708
N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-(5-phenyl-1,3-oxazol-2-yl)benzamide
CID 46532816
2-[5-(4-bromophenyl)-1,3-oxazol-2-yl]-N-(3,4-dimethylphenyl)benzamide
CID 100509056
2-[5-(3-bromophenyl)-1,3-oxazol-2-yl]-N-(4-chlorophenyl)benzamide
CID 100511057
S-[4-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]phenyl] N,N-dimethylcarbamothioate
CID 56533280
2-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide
CID 36704097
N-(3-chlorophenyl)-2-[5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]benzamide
CID 100504316
2-(5-phenyl-1,3-oxazol-2-yl)-N-[4-(sulfamoylmethyl)phenyl]benzamide
CID 24676064
N-(3,5-dichlorophenyl)-2-[5-(3-methoxyphenyl)-1,3-oxazol-2-yl]benzamide
CID 100500666
2-[5-(4-ethoxyphenyl)-1,3-oxazol-2-yl]-N-phenylbenzamide
CID 100504090

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-methyl-5-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]benzamide?
The IUPAC name of 2-chloro-N-methyl-5-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]benzamide (CID 55836034) is 2-chloro-N-methyl-5-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]benzamide.
What is the SMILES notation for 2-chloro-N-methyl-5-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]benzamide?
The canonical SMILES for 2-chloro-N-methyl-5-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]benzamide is CNC(=O)c1cc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)ccc1Cl.
What is the InChIKey of 2-chloro-N-methyl-5-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]benzamide?
The InChIKey is OFPMVPUBFMYIBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18ClN3O3/c1-26-22(29)19-13-16(11-12-20(19)25)28-23(30)17-9-5-6-10-18(17)24-27-14-21(31-24)15-7-3-2-4-8-15/h2-14H,1H3,(H,26,29)(H,28,30).
What are the key properties of 2-chloro-N-methyl-5-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]benzamide?
2-chloro-N-methyl-5-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]benzamide has a molecular weight of 431.88 g/mol, XLogP of 5.27, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-methyl-5-[[2-(5-phenyl-1,3-oxazol-2-yl)benzoyl]amino]benzamide is sourced from PubChem (CID 55836034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).