N-(2-bromophenyl)-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide

C17H14BrN3O2 — CID 110371988

IUPACN-(2-bromophenyl)-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide
SMILESCc1oc(-c2cccnc2)nc1CC(=O)Nc1ccccc1Br
InChIInChI=1S/C17H14BrN3O2/c1-11-15(21-17(23-11)12-5-4-8-19-10-12)9-16(22)20-14-7-3-2-6-13(14)18/h2-8,10H,9H2,1H3,(H,20,22)
InChIKeyJIKWJWPCRQZAKZ-UHFFFAOYSA-N
MW372.22 g/mol
LogP3.99
Rot. Bonds4

About N-(2-bromophenyl)-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide

N-(2-bromophenyl)-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide (PubChem CID 110371988) has the molecular formula C17H14BrN3O2 and a molecular weight of 372.22 g/mol. Its IUPAC name is N-(2-bromophenyl)-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(2-bromophenyl)-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide
PubChem CID110371988
Molecular FormulaC17H14BrN3O2
Molecular Weight372.22 g/mol
Exact Mass371.03
IUPAC NameN-(2-bromophenyl)-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide
SMILESCc1oc(-c2cccnc2)nc1CC(=O)Nc1ccccc1Br
InChIInChI=1S/C17H14BrN3O2/c1-11-15(21-17(23-11)12-5-4-8-19-10-12)9-16(22)20-14-7-3-2-6-13(14)18/h2-8,10H,9H2,1H3,(H,20,22)
InChIKeyJIKWJWPCRQZAKZ-UHFFFAOYSA-N
XLogP3.99
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.22
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)-N-(1-phenylethyl)acetamide
CID 110371879
N-butyl-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide
CID 110371856
2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-quinolin-8-ylacetamide
CID 16622456
2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-naphthalen-1-ylacetamide
CID 16614398
N-[(4-fluorophenyl)methyl]-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide
CID 110371882
N-[3-(dimethylamino)propyl]-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide
CID 110371871
2-[2-(3-bromophenyl)-5-methyl-1,3-oxazol-4-yl]-N-(2-fluorophenyl)acetamide
CID 110420304
N-[(4-methoxyphenyl)methyl]-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide
CID 110371886
2-[2-(3-bromophenyl)-5-methyl-1,3-oxazol-4-yl]-N-(2-cyanophenyl)acetamide
CID 110428424
2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)-1-pyrrolidin-1-ylethanone
CID 110371859
N-(2-methoxyphenyl)-2-[2-(3-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
CID 110356012
2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(2-propoxyphenyl)acetamide
CID 16614535

Frequently Asked Questions

What is the IUPAC name of N-(2-bromophenyl)-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide?
The IUPAC name of N-(2-bromophenyl)-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide (CID 110371988) is N-(2-bromophenyl)-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide.
What is the SMILES notation for N-(2-bromophenyl)-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide?
The canonical SMILES for N-(2-bromophenyl)-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide is Cc1oc(-c2cccnc2)nc1CC(=O)Nc1ccccc1Br.
What is the InChIKey of N-(2-bromophenyl)-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide?
The InChIKey is JIKWJWPCRQZAKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14BrN3O2/c1-11-15(21-17(23-11)12-5-4-8-19-10-12)9-16(22)20-14-7-3-2-6-13(14)18/h2-8,10H,9H2,1H3,(H,20,22).
What are the key properties of N-(2-bromophenyl)-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide?
N-(2-bromophenyl)-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide has a molecular weight of 372.22 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromophenyl)-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide is sourced from PubChem (CID 110371988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).