4-bromo-N-[(2-chlorophenyl)methyl]-3-hydroxybenzamide

C14H11BrClNO2 — CID 103830389

IUPAC4-bromo-N-[(2-chlorophenyl)methyl]-3-hydroxybenzamide
SMILESO=C(NCc1ccccc1Cl)c1ccc(Br)c(O)c1
InChIInChI=1S/C14H11BrClNO2/c15-11-6-5-9(7-13(11)18)14(19)17-8-10-3-1-2-4-12(10)16/h1-7,18H,8H2,(H,17,19)
InChIKeyOGNAARGGTUWEEX-UHFFFAOYSA-N
MW340.60 g/mol
LogP3.74
Rot. Bonds3

About 4-bromo-N-[(2-chlorophenyl)methyl]-3-hydroxybenzamide

4-bromo-N-[(2-chlorophenyl)methyl]-3-hydroxybenzamide (PubChem CID 103830389) has the molecular formula C14H11BrClNO2 and a molecular weight of 340.60 g/mol. Its IUPAC name is 4-bromo-N-[(2-chlorophenyl)methyl]-3-hydroxybenzamide.

Molecular Properties

Compound Name4-bromo-N-[(2-chlorophenyl)methyl]-3-hydroxybenzamide
PubChem CID103830389
Molecular FormulaC14H11BrClNO2
Molecular Weight340.60 g/mol
Exact Mass338.97
IUPAC Name4-bromo-N-[(2-chlorophenyl)methyl]-3-hydroxybenzamide
SMILESO=C(NCc1ccccc1Cl)c1ccc(Br)c(O)c1
InChIInChI=1S/C14H11BrClNO2/c15-11-6-5-9(7-13(11)18)14(19)17-8-10-3-1-2-4-12(10)16/h1-7,18H,8H2,(H,17,19)
InChIKeyOGNAARGGTUWEEX-UHFFFAOYSA-N
XLogP3.74
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.60
LogP ≤ 53.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-3-hydroxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 103830352
4-bromo-3-chloro-N-[(2-fluorophenyl)methyl]benzamide
CID 81307450
3-chloro-4-fluoro-N-[(2-hydroxyphenyl)methyl]benzamide
CID 115732894
3-chloro-N-[(2-hydroxyphenyl)methyl]-4-methylbenzamide
CID 115610944
3-amino-N-[(2-bromophenyl)methyl]-4-chlorobenzamide
CID 61401723
N-[(2-chlorophenyl)methyl]-2-oxo-1H-pyridine-4-carboxamide
CID 110600760
N-[(2-chlorophenyl)methyl]-4-methoxy-3-sulfamoylbenzamide
CID 36861804
[4-[(2-chlorophenyl)methylcarbamoyl]phenyl]boronic acid
CID 138991708
1-N-[(2-chlorophenyl)methyl]-4-N-(2-methylpropyl)benzene-1,4-dicarboxamide
CID 109043860
3,5-dibromo-N-[(2-hydroxyphenyl)methyl]benzamide
CID 103909337
N-[(2-chlorophenyl)methyl]-3-methoxybenzamide
CID 790117
3-N-tert-butyl-1-N-[(2-chlorophenyl)methyl]benzene-1,3-dicarboxamide
CID 109054733

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-[(2-chlorophenyl)methyl]-3-hydroxybenzamide?
The IUPAC name of 4-bromo-N-[(2-chlorophenyl)methyl]-3-hydroxybenzamide (CID 103830389) is 4-bromo-N-[(2-chlorophenyl)methyl]-3-hydroxybenzamide.
What is the SMILES notation for 4-bromo-N-[(2-chlorophenyl)methyl]-3-hydroxybenzamide?
The canonical SMILES for 4-bromo-N-[(2-chlorophenyl)methyl]-3-hydroxybenzamide is O=C(NCc1ccccc1Cl)c1ccc(Br)c(O)c1.
What is the InChIKey of 4-bromo-N-[(2-chlorophenyl)methyl]-3-hydroxybenzamide?
The InChIKey is OGNAARGGTUWEEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11BrClNO2/c15-11-6-5-9(7-13(11)18)14(19)17-8-10-3-1-2-4-12(10)16/h1-7,18H,8H2,(H,17,19).
What are the key properties of 4-bromo-N-[(2-chlorophenyl)methyl]-3-hydroxybenzamide?
4-bromo-N-[(2-chlorophenyl)methyl]-3-hydroxybenzamide has a molecular weight of 340.60 g/mol, XLogP of 3.74, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-[(2-chlorophenyl)methyl]-3-hydroxybenzamide is sourced from PubChem (CID 103830389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).