N-(2-bromoprop-2-enyl)-4-chloro-2-hydroxybenzamide

C10H9BrClNO2 — CID 115595089

IUPACN-(2-bromoprop-2-enyl)-4-chloro-2-hydroxybenzamide
SMILESC=C(Br)CNC(=O)c1ccc(Cl)cc1O
InChIInChI=1S/C10H9BrClNO2/c1-6(11)5-13-10(15)8-3-2-7(12)4-9(8)14/h2-4,14H,1,5H2,(H,13,15)
InChIKeyYCFOUZLFEHBKTF-UHFFFAOYSA-N
MW290.54 g/mol
LogP2.68
Rot. Bonds3

About N-(2-bromoprop-2-enyl)-4-chloro-2-hydroxybenzamide

N-(2-bromoprop-2-enyl)-4-chloro-2-hydroxybenzamide (PubChem CID 115595089) has the molecular formula C10H9BrClNO2 and a molecular weight of 290.54 g/mol. Its IUPAC name is N-(2-bromoprop-2-enyl)-4-chloro-2-hydroxybenzamide.

Molecular Properties

Compound NameN-(2-bromoprop-2-enyl)-4-chloro-2-hydroxybenzamide
PubChem CID115595089
Molecular FormulaC10H9BrClNO2
Molecular Weight290.54 g/mol
Exact Mass288.95
IUPAC NameN-(2-bromoprop-2-enyl)-4-chloro-2-hydroxybenzamide
SMILESC=C(Br)CNC(=O)c1ccc(Cl)cc1O
InChIInChI=1S/C10H9BrClNO2/c1-6(11)5-13-10(15)8-3-2-7(12)4-9(8)14/h2-4,14H,1,5H2,(H,13,15)
InChIKeyYCFOUZLFEHBKTF-UHFFFAOYSA-N
XLogP2.68
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.54
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromoethyl)-4-chloro-2-hydroxybenzamide
CID 114307488
N-[2-(tert-butylamino)-2-oxoethyl]-4-chloro-2-hydroxybenzamide
CID 115279278
4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide
CID 114296442
4-chloro-2-hydroxy-N-[(2-hydroxyphenyl)methyl]benzamide
CID 115598912
4-chloro-2-hydroxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide
CID 115577293
N-(2-bromoprop-2-enyl)-5-fluoro-2-hydroxybenzamide
CID 115681931
5-chloro-2-hydroxy-N-(2-methylprop-2-enyl)benzamide
CID 114617404
4-chloro-N-(3-chloro-2,2-dimethylpropyl)-2-hydroxybenzamide
CID 115364597
N-(2-bromoprop-2-enyl)-2,3-dichlorobenzamide
CID 47439235
4-chloro-2-hydroxy-N-(5-iodopentyl)benzamide
CID 107322316
sodium;N-butyl-4-chloro-2-hydroxybenzamide;hydride
CID 174574548
4-chloro-2-hydroxy-N-(2-methylbutyl)benzamide
CID 62692259

Frequently Asked Questions

What is the IUPAC name of N-(2-bromoprop-2-enyl)-4-chloro-2-hydroxybenzamide?
The IUPAC name of N-(2-bromoprop-2-enyl)-4-chloro-2-hydroxybenzamide (CID 115595089) is N-(2-bromoprop-2-enyl)-4-chloro-2-hydroxybenzamide.
What is the SMILES notation for N-(2-bromoprop-2-enyl)-4-chloro-2-hydroxybenzamide?
The canonical SMILES for N-(2-bromoprop-2-enyl)-4-chloro-2-hydroxybenzamide is C=C(Br)CNC(=O)c1ccc(Cl)cc1O.
What is the InChIKey of N-(2-bromoprop-2-enyl)-4-chloro-2-hydroxybenzamide?
The InChIKey is YCFOUZLFEHBKTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrClNO2/c1-6(11)5-13-10(15)8-3-2-7(12)4-9(8)14/h2-4,14H,1,5H2,(H,13,15).
What are the key properties of N-(2-bromoprop-2-enyl)-4-chloro-2-hydroxybenzamide?
N-(2-bromoprop-2-enyl)-4-chloro-2-hydroxybenzamide has a molecular weight of 290.54 g/mol, XLogP of 2.68, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromoprop-2-enyl)-4-chloro-2-hydroxybenzamide is sourced from PubChem (CID 115595089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).