N-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide

C18H15ClN2O2 — CID 16590370

IUPACN-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
SMILESO=C(CCc1ncc(-c2ccccc2)o1)Nc1ccccc1Cl
InChIInChI=1S/C18H15ClN2O2/c19-14-8-4-5-9-15(14)21-17(22)10-11-18-20-12-16(23-18)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,21,22)
InChIKeyVXIQCWRKIUAYQF-UHFFFAOYSA-N
MW326.78 g/mol
LogP4.57
Rot. Bonds5

About N-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide

N-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide (PubChem CID 16590370) has the molecular formula C18H15ClN2O2 and a molecular weight of 326.78 g/mol. Its IUPAC name is N-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
PubChem CID16590370
Molecular FormulaC18H15ClN2O2
Molecular Weight326.78 g/mol
Exact Mass326.08
IUPAC NameN-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
SMILESO=C(CCc1ncc(-c2ccccc2)o1)Nc1ccccc1Cl
InChIInChI=1S/C18H15ClN2O2/c19-14-8-4-5-9-15(14)21-17(22)10-11-18-20-12-16(23-18)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,21,22)
InChIKeyVXIQCWRKIUAYQF-UHFFFAOYSA-N
XLogP4.57
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.78
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(2-chloroanilino)-2-oxoethyl] 3-(5-phenyl-1,3-oxazol-2-yl)propanoate
CID 42295659
N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 51316456
N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 51311777
N-(2,4-dibromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 16591578
N-[2-[(2-chlorophenyl)methyl]pyrazol-3-yl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 16600619
N-[1-(2-chlorophenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 51310753
N-(2,5-dichlorophenyl)-3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propanamide
CID 51511272
3-[5-(2-chlorophenyl)-1,3-oxazol-2-yl]-N-[2-(3-phenyl-1H-1,2,4-triazol-5-yl)phenyl]propanamide
CID 55991548
3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-(2-methylphenyl)propanamide
CID 16590316
3-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]-N-(2-propoxyphenyl)propanamide
CID 46525988
N-(3-chloro-2-morpholin-4-ylphenyl)-3-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]propanamide
CID 41270984
N-phenyl-4-(5-phenyl-1,3-oxazol-2-yl)butanamide
CID 38885502

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
The IUPAC name of N-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide (CID 16590370) is N-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide.
What is the SMILES notation for N-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
The canonical SMILES for N-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide is O=C(CCc1ncc(-c2ccccc2)o1)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
The InChIKey is VXIQCWRKIUAYQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN2O2/c19-14-8-4-5-9-15(14)21-17(22)10-11-18-20-12-16(23-18)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H,21,22).
What are the key properties of N-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
N-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide has a molecular weight of 326.78 g/mol, XLogP of 4.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide is sourced from PubChem (CID 16590370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).