N-(2,4-dibromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide

C18H14Br2N2O2 — CID 16591578

IUPACN-(2,4-dibromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
SMILESO=C(CCc1ncc(-c2ccccc2)o1)Nc1ccc(Br)cc1Br
InChIInChI=1S/C18H14Br2N2O2/c19-13-6-7-15(14(20)10-13)22-17(23)8-9-18-21-11-16(24-18)12-4-2-1-3-5-12/h1-7,10-11H,8-9H2,(H,22,23)
InChIKeyYYWNHKQMVLHSFS-UHFFFAOYSA-N
MW450.13 g/mol
LogP5.44
Rot. Bonds5

About N-(2,4-dibromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide

N-(2,4-dibromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide (PubChem CID 16591578) has the molecular formula C18H14Br2N2O2 and a molecular weight of 450.13 g/mol. Its IUPAC name is N-(2,4-dibromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide.

Molecular Properties

Compound NameN-(2,4-dibromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
PubChem CID16591578
Molecular FormulaC18H14Br2N2O2
Molecular Weight450.13 g/mol
Exact Mass447.94
IUPAC NameN-(2,4-dibromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
SMILESO=C(CCc1ncc(-c2ccccc2)o1)Nc1ccc(Br)cc1Br
InChIInChI=1S/C18H14Br2N2O2/c19-13-6-7-15(14(20)10-13)22-17(23)8-9-18-21-11-16(24-18)12-4-2-1-3-5-12/h1-7,10-11H,8-9H2,(H,22,23)
InChIKeyYYWNHKQMVLHSFS-UHFFFAOYSA-N
XLogP5.44
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500450.13
LogP ≤ 55.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4-dibromophenyl)-3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanamide
CID 16591581
N-(5-bromo-2-methoxyphenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 55905133
N-(3-bromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 16590292
N-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 16590370
N-(2-bromophenyl)-3-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]propanamide
CID 95047586
N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 51311777
N-(6-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 51316456
N-(2-methoxy-5-methylphenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 51309889
N-(2-bromophenyl)-3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]propanamide
CID 16590286
3-fluoro-4-methyl-5-[3-(5-phenyl-1,3-oxazol-2-yl)propanoylamino]benzamide
CID 55784491
N-phenyl-4-(5-phenyl-1,3-oxazol-2-yl)butanamide
CID 38885502
(4-bromo-2-chlorophenyl) 3-(5-phenyl-1,3-oxazol-2-yl)propanoate
CID 16591931

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dibromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
The IUPAC name of N-(2,4-dibromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide (CID 16591578) is N-(2,4-dibromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide.
What is the SMILES notation for N-(2,4-dibromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
The canonical SMILES for N-(2,4-dibromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide is O=C(CCc1ncc(-c2ccccc2)o1)Nc1ccc(Br)cc1Br.
What is the InChIKey of N-(2,4-dibromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
The InChIKey is YYWNHKQMVLHSFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14Br2N2O2/c19-13-6-7-15(14(20)10-13)22-17(23)8-9-18-21-11-16(24-18)12-4-2-1-3-5-12/h1-7,10-11H,8-9H2,(H,22,23).
What are the key properties of N-(2,4-dibromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
N-(2,4-dibromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide has a molecular weight of 450.13 g/mol, XLogP of 5.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dibromophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide is sourced from PubChem (CID 16591578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).