5-bromo-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxybenzamide

C17H17BrN2O4 — CID 32938270

IUPAC5-bromo-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxybenzamide
SMILESCCNC(=O)COc1ccc(NC(=O)c2cc(Br)ccc2O)cc1
InChIInChI=1S/C17H17BrN2O4/c1-2-19-16(22)10-24-13-6-4-12(5-7-13)20-17(23)14-9-11(18)3-8-15(14)21/h3-9,21H,2,10H2,1H3,(H,19,22)(H,20,23)
InChIKeyNRFVWNZXGIXKHD-UHFFFAOYSA-N
MW393.24 g/mol
LogP2.92
Rot. Bonds6

About 5-bromo-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxybenzamide

5-bromo-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxybenzamide (PubChem CID 32938270) has the molecular formula C17H17BrN2O4 and a molecular weight of 393.24 g/mol. Its IUPAC name is 5-bromo-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxybenzamide.

Molecular Properties

Compound Name5-bromo-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxybenzamide
PubChem CID32938270
Molecular FormulaC17H17BrN2O4
Molecular Weight393.24 g/mol
Exact Mass392.04
IUPAC Name5-bromo-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxybenzamide
SMILESCCNC(=O)COc1ccc(NC(=O)c2cc(Br)ccc2O)cc1
InChIInChI=1S/C17H17BrN2O4/c1-2-19-16(22)10-24-13-6-4-12(5-7-13)20-17(23)14-9-11(18)3-8-15(14)21/h3-9,21H,2,10H2,1H3,(H,19,22)(H,20,23)
InChIKeyNRFVWNZXGIXKHD-UHFFFAOYSA-N
XLogP2.92
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.24
LogP ≤ 52.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxy-5-methylbenzamide
CID 32937197
N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxy-4-methylbenzamide
CID 38497709
5-bromo-2-hydroxy-N-(4-methoxyphenyl)benzamide
CID 14963005
N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-iodobenzamide
CID 32937991
N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-methyl-5-methylsulfanylbenzamide
CID 32941425
1-(4-bromophenyl)-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]cyclopropane-1-carboxamide
CID 32941075
5-bromo-N-(4-bromophenyl)-2-hydroxybenzamide;5-bromo-2-hydroxy-N-phenylbenzamide
CID 175557226
N-(4-ethoxyphenyl)-5-fluoro-2-hydroxybenzamide
CID 79532343
2-[[2-(6-bromonaphthalen-2-yl)oxyacetyl]amino]-N-ethylacetamide
CID 9231222
2-bromo-N-[3-[2-(ethylamino)-2-oxoethoxy]phenyl]benzamide
CID 34875961
4-bromo-N-(4-ethoxyphenyl)-2-sulfanylbenzamide
CID 107019834
5-bromo-N'-(4-ethoxybenzoyl)-2-hydroxybenzohydrazide
CID 27163290

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxybenzamide?
The IUPAC name of 5-bromo-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxybenzamide (CID 32938270) is 5-bromo-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxybenzamide.
What is the SMILES notation for 5-bromo-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxybenzamide?
The canonical SMILES for 5-bromo-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxybenzamide is CCNC(=O)COc1ccc(NC(=O)c2cc(Br)ccc2O)cc1.
What is the InChIKey of 5-bromo-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxybenzamide?
The InChIKey is NRFVWNZXGIXKHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17BrN2O4/c1-2-19-16(22)10-24-13-6-4-12(5-7-13)20-17(23)14-9-11(18)3-8-15(14)21/h3-9,21H,2,10H2,1H3,(H,19,22)(H,20,23).
What are the key properties of 5-bromo-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxybenzamide?
5-bromo-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxybenzamide has a molecular weight of 393.24 g/mol, XLogP of 2.92, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-[4-[2-(ethylamino)-2-oxoethoxy]phenyl]-2-hydroxybenzamide is sourced from PubChem (CID 32938270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).