5-bromo-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-hydroxybenzamide

C17H14BrClN2O3 — CID 25495530

IUPAC5-bromo-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-hydroxybenzamide
SMILESO=C(Nc1ccc(N2CCCC2=O)c(Cl)c1)c1cc(Br)ccc1O
InChIInChI=1S/C17H14BrClN2O3/c18-10-3-6-15(22)12(8-10)17(24)20-11-4-5-14(13(19)9-11)21-7-1-2-16(21)23/h3-6,8-9,22H,1-2,7H2,(H,20,24)
InChIKeyQLMGWZKUWFRSHE-UHFFFAOYSA-N
MW409.67 g/mol
LogP4.19
Rot. Bonds3

About 5-bromo-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-hydroxybenzamide

5-bromo-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-hydroxybenzamide (PubChem CID 25495530) has the molecular formula C17H14BrClN2O3 and a molecular weight of 409.67 g/mol. Its IUPAC name is 5-bromo-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-hydroxybenzamide.

Molecular Properties

Compound Name5-bromo-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-hydroxybenzamide
PubChem CID25495530
Molecular FormulaC17H14BrClN2O3
Molecular Weight409.67 g/mol
Exact Mass407.99
IUPAC Name5-bromo-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-hydroxybenzamide
SMILESO=C(Nc1ccc(N2CCCC2=O)c(Cl)c1)c1cc(Br)ccc1O
InChIInChI=1S/C17H14BrClN2O3/c18-10-3-6-15(22)12(8-10)17(24)20-11-4-5-14(13(19)9-11)21-7-1-2-16(21)23/h3-6,8-9,22H,1-2,7H2,(H,20,24)
InChIKeyQLMGWZKUWFRSHE-UHFFFAOYSA-N
XLogP4.19
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.67
LogP ≤ 54.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-4-chlorophenyl)-5-bromo-2-hydroxybenzamide
CID 107729182
N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-(2-cyanophenyl)sulfanylbenzamide
CID 46531626
1-[2-chloro-4-(methylamino)phenyl]pyrrolidin-2-one
CID 63090019
N-(4-acetamido-3-chlorophenyl)-5-bromo-2-hydroxybenzamide
CID 25470533
2-chloro-N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686645
N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]quinoxaline-2-carboxamide
CID 17452256
5-bromo-2-chloro-N-(3-chloro-4-morpholin-4-ylphenyl)benzamide
CID 3540597
N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-5-hydroxypentanamide
CID 79194755
5-bromo-N-(3,5-dichloro-4-fluorophenyl)-2-hydroxybenzamide
CID 107729876
2-bromo-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686588
2,4-dichloro-N-[3-methoxy-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686691
2-chloro-3-methyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 131946801

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-hydroxybenzamide?
The IUPAC name of 5-bromo-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-hydroxybenzamide (CID 25495530) is 5-bromo-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-hydroxybenzamide.
What is the SMILES notation for 5-bromo-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-hydroxybenzamide?
The canonical SMILES for 5-bromo-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-hydroxybenzamide is O=C(Nc1ccc(N2CCCC2=O)c(Cl)c1)c1cc(Br)ccc1O.
What is the InChIKey of 5-bromo-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-hydroxybenzamide?
The InChIKey is QLMGWZKUWFRSHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14BrClN2O3/c18-10-3-6-15(22)12(8-10)17(24)20-11-4-5-14(13(19)9-11)21-7-1-2-16(21)23/h3-6,8-9,22H,1-2,7H2,(H,20,24).
What are the key properties of 5-bromo-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-hydroxybenzamide?
5-bromo-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-hydroxybenzamide has a molecular weight of 409.67 g/mol, XLogP of 4.19, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-[3-chloro-4-(2-oxopyrrolidin-1-yl)phenyl]-2-hydroxybenzamide is sourced from PubChem (CID 25495530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).