2-(6-bromo-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide

C19H17BrN2O2 — CID 100736460

IUPAC2-(6-bromo-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide
SMILESCc1ccc(C)c(NC(=O)Cn2ccc(=O)c3cc(Br)ccc32)c1
InChIInChI=1S/C19H17BrN2O2/c1-12-3-4-13(2)16(9-12)21-19(24)11-22-8-7-18(23)15-10-14(20)5-6-17(15)22/h3-10H,11H2,1-2H3,(H,21,24)
InChIKeyUVZTVBXJMYAJFO-UHFFFAOYSA-N
MW385.26 g/mol
LogP4.02
Rot. Bonds3

About 2-(6-bromo-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide

2-(6-bromo-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide (PubChem CID 100736460) has the molecular formula C19H17BrN2O2 and a molecular weight of 385.26 g/mol. Its IUPAC name is 2-(6-bromo-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide.

Molecular Properties

Compound Name2-(6-bromo-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide
PubChem CID100736460
Molecular FormulaC19H17BrN2O2
Molecular Weight385.26 g/mol
Exact Mass384.05
IUPAC Name2-(6-bromo-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide
SMILESCc1ccc(C)c(NC(=O)Cn2ccc(=O)c3cc(Br)ccc32)c1
InChIInChI=1S/C19H17BrN2O2/c1-12-3-4-13(2)16(9-12)21-19(24)11-22-8-7-18(23)15-10-14(20)5-6-17(15)22/h3-10H,11H2,1-2H3,(H,21,24)
InChIKeyUVZTVBXJMYAJFO-UHFFFAOYSA-N
XLogP4.02
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.26
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(6-chloro-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide
CID 100734930
N-(3-bromophenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide
CID 100741597
2-(7-bromo-4-oxoquinolin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide
CID 100740360
2-(6-bromo-4-oxoquinolin-1-yl)-N-ethylacetamide
CID 100736017
N-(2,3-dimethylphenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide
CID 100741423
2-(6-bromo-4-oxoquinolin-1-yl)-N-(2-ethyl-6-methylphenyl)acetamide
CID 100736482
N-(2,5-dimethylphenyl)-2-(5-ethyl-4-oxopyrrolo[3,2-c]pyridin-1-yl)acetamide
CID 46395562
2-[4-[[2-(6-bromo-4-oxoquinolin-1-yl)acetyl]amino]phenyl]acetamide
CID 100779672
2-(7-bromo-4-oxoquinolin-1-yl)-N-(3,5-dimethylphenyl)acetamide
CID 100739906
N-(4-chlorophenyl)-2-(6-methyl-4-oxoquinolin-1-yl)acetamide
CID 100741578
2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide
CID 100741082
2-(6-bromo-4-oxoquinolin-1-yl)-N-(3,4-dimethoxyphenyl)acetamide
CID 100736984

Frequently Asked Questions

What is the IUPAC name of 2-(6-bromo-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide?
The IUPAC name of 2-(6-bromo-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide (CID 100736460) is 2-(6-bromo-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide.
What is the SMILES notation for 2-(6-bromo-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide?
The canonical SMILES for 2-(6-bromo-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide is Cc1ccc(C)c(NC(=O)Cn2ccc(=O)c3cc(Br)ccc32)c1.
What is the InChIKey of 2-(6-bromo-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide?
The InChIKey is UVZTVBXJMYAJFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17BrN2O2/c1-12-3-4-13(2)16(9-12)21-19(24)11-22-8-7-18(23)15-10-14(20)5-6-17(15)22/h3-10H,11H2,1-2H3,(H,21,24).
What are the key properties of 2-(6-bromo-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide?
2-(6-bromo-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide has a molecular weight of 385.26 g/mol, XLogP of 4.02, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-bromo-4-oxoquinolin-1-yl)-N-(2,5-dimethylphenyl)acetamide is sourced from PubChem (CID 100736460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).