N-(4-bromophenyl)-2-(3-ethyl-2-oxoimidazol-1-yl)acetamide

C13H14BrN3O2 — CID 116624275

IUPACN-(4-bromophenyl)-2-(3-ethyl-2-oxoimidazol-1-yl)acetamide
SMILESCCn1ccn(CC(=O)Nc2ccc(Br)cc2)c1=O
InChIInChI=1S/C13H14BrN3O2/c1-2-16-7-8-17(13(16)19)9-12(18)15-11-5-3-10(14)4-6-11/h3-8H,2,9H2,1H3,(H,15,18)
InChIKeyLWOSWNGQUDOSTC-UHFFFAOYSA-N
MW324.18 g/mol
LogP2.07
Rot. Bonds4

About N-(4-bromophenyl)-2-(3-ethyl-2-oxoimidazol-1-yl)acetamide

N-(4-bromophenyl)-2-(3-ethyl-2-oxoimidazol-1-yl)acetamide (PubChem CID 116624275) has the molecular formula C13H14BrN3O2 and a molecular weight of 324.18 g/mol. Its IUPAC name is N-(4-bromophenyl)-2-(3-ethyl-2-oxoimidazol-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-bromophenyl)-2-(3-ethyl-2-oxoimidazol-1-yl)acetamide
PubChem CID116624275
Molecular FormulaC13H14BrN3O2
Molecular Weight324.18 g/mol
Exact Mass323.03
IUPAC NameN-(4-bromophenyl)-2-(3-ethyl-2-oxoimidazol-1-yl)acetamide
SMILESCCn1ccn(CC(=O)Nc2ccc(Br)cc2)c1=O
InChIInChI=1S/C13H14BrN3O2/c1-2-16-7-8-17(13(16)19)9-12(18)15-11-5-3-10(14)4-6-11/h3-8H,2,9H2,1H3,(H,15,18)
InChIKeyLWOSWNGQUDOSTC-UHFFFAOYSA-N
XLogP2.07
TPSA56.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.18
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-bromophenyl)-2-(2-oxo-3-propan-2-ylimidazol-1-yl)acetamide
CID 116625100
2-(3-ethyl-2-oxoimidazol-1-yl)-N-(3-methylphenyl)acetamide
CID 116624138
2-[2-(4-bromoanilino)-2-oxoethyl]sulfanyl-N-(4-bromophenyl)acetamide
CID 3567894
N-(4-bromophenyl)-2-(6-methylindol-1-yl)acetamide
CID 116546776
2-(5-bromoindol-1-yl)-N-(4-bromophenyl)acetamide
CID 4291378
N-(4-bromophenyl)-2-[2-(ethylaminomethyl)imidazol-1-yl]acetamide
CID 62223377
2-(5-bromo-4-methyl-6-oxopyrimidin-1-yl)-N-(4-bromophenyl)acetamide
CID 66308143
N-[4-(4-bromophenyl)sulfanylphenyl]-2-(2-oxo-1-pyridinyl)acetamide
CID 46525245
N-(4-bromophenyl)-2-[2-(propylaminomethyl)imidazol-1-yl]acetamide
CID 62221270
N-(4-acetylphenyl)-2-[2-(4-bromoanilino)-2-oxoethyl]sulfanylacetamide
CID 5085970
N-(4-bromophenyl)-2-(6-chloro-4-oxoquinolin-1-yl)acetamide
CID 43833238
2-(5-amino-3-bromo-2-oxo-1-pyridinyl)-N-(4-bromophenyl)acetamide
CID 80501784

Frequently Asked Questions

What is the IUPAC name of N-(4-bromophenyl)-2-(3-ethyl-2-oxoimidazol-1-yl)acetamide?
The IUPAC name of N-(4-bromophenyl)-2-(3-ethyl-2-oxoimidazol-1-yl)acetamide (CID 116624275) is N-(4-bromophenyl)-2-(3-ethyl-2-oxoimidazol-1-yl)acetamide.
What is the SMILES notation for N-(4-bromophenyl)-2-(3-ethyl-2-oxoimidazol-1-yl)acetamide?
The canonical SMILES for N-(4-bromophenyl)-2-(3-ethyl-2-oxoimidazol-1-yl)acetamide is CCn1ccn(CC(=O)Nc2ccc(Br)cc2)c1=O.
What is the InChIKey of N-(4-bromophenyl)-2-(3-ethyl-2-oxoimidazol-1-yl)acetamide?
The InChIKey is LWOSWNGQUDOSTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14BrN3O2/c1-2-16-7-8-17(13(16)19)9-12(18)15-11-5-3-10(14)4-6-11/h3-8H,2,9H2,1H3,(H,15,18).
What are the key properties of N-(4-bromophenyl)-2-(3-ethyl-2-oxoimidazol-1-yl)acetamide?
N-(4-bromophenyl)-2-(3-ethyl-2-oxoimidazol-1-yl)acetamide has a molecular weight of 324.18 g/mol, XLogP of 2.07, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-bromophenyl)-2-(3-ethyl-2-oxoimidazol-1-yl)acetamide is sourced from PubChem (CID 116624275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).