3,5-dibromo-N-cyclohexyl-N-ethyl-2-hydroxybenzamide

C15H19Br2NO2 — CID 154162660

IUPAC3,5-dibromo-N-cyclohexyl-N-ethyl-2-hydroxybenzamide
SMILESCCN(C(=O)c1cc(Br)cc(Br)c1O)C1CCCCC1
InChIInChI=1S/C15H19Br2NO2/c1-2-18(11-6-4-3-5-7-11)15(20)12-8-10(16)9-13(17)14(12)19/h8-9,11,19H,2-7H2,1H3
InChIKeyGOBHPJAZGSDEPM-UHFFFAOYSA-N
MW405.13 g/mol
LogP4.71
Rot. Bonds3

About 3,5-dibromo-N-cyclohexyl-N-ethyl-2-hydroxybenzamide

3,5-dibromo-N-cyclohexyl-N-ethyl-2-hydroxybenzamide (PubChem CID 154162660) has the molecular formula C15H19Br2NO2 and a molecular weight of 405.13 g/mol. Its IUPAC name is 3,5-dibromo-N-cyclohexyl-N-ethyl-2-hydroxybenzamide.

Molecular Properties

Compound Name3,5-dibromo-N-cyclohexyl-N-ethyl-2-hydroxybenzamide
PubChem CID154162660
Molecular FormulaC15H19Br2NO2
Molecular Weight405.13 g/mol
Exact Mass402.98
IUPAC Name3,5-dibromo-N-cyclohexyl-N-ethyl-2-hydroxybenzamide
SMILESCCN(C(=O)c1cc(Br)cc(Br)c1O)C1CCCCC1
InChIInChI=1S/C15H19Br2NO2/c1-2-18(11-6-4-3-5-7-11)15(20)12-8-10(16)9-13(17)14(12)19/h8-9,11,19H,2-7H2,1H3
InChIKeyGOBHPJAZGSDEPM-UHFFFAOYSA-N
XLogP4.71
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.13
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-Bromo-N-[3-(dimethylamino)propyl]-2-hydroxybenzamide
CID 547207
3,5-Dibromosalicylamide
CID 352428
Benzamide, 5-bromo-N,3-dimethyl-2-hydroxy-
CID 38708
Benzamide, 5-bromo-N-ethyl-2-hydroxy-3-methyl-
CID 38709
Bensalan
CID 27449
N-benzyl-3,5-dibromo-2-hydroxy-benzamide
CID 10916003
Benzamide, 5-bromo-N-butyl-2-hydroxy-3-methyl-
CID 38710
Benzamide, 5-bromo-2-hydroxy-3-methyl-N-(1-methylethyl)-
CID 42813
Benzamide, 5-bromo-N-cyclopropyl-2-hydroxy-3-methyl-
CID 42814
Benzamide, 5-bromo-2-hydroxy-3-methyl-N-(2-methylpropyl)-
CID 38711
3,5-dibromo-N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-hydroxybenzamide
CID 2484940
3,5-dibromo-N-[(4-chlorophenyl)methyl]-2-hydroxybenzamide
CID 352423

Frequently Asked Questions

What is the IUPAC name of 3,5-dibromo-N-cyclohexyl-N-ethyl-2-hydroxybenzamide?
The IUPAC name of 3,5-dibromo-N-cyclohexyl-N-ethyl-2-hydroxybenzamide (CID 154162660) is 3,5-dibromo-N-cyclohexyl-N-ethyl-2-hydroxybenzamide.
What is the SMILES notation for 3,5-dibromo-N-cyclohexyl-N-ethyl-2-hydroxybenzamide?
The canonical SMILES for 3,5-dibromo-N-cyclohexyl-N-ethyl-2-hydroxybenzamide is CCN(C(=O)c1cc(Br)cc(Br)c1O)C1CCCCC1.
What is the InChIKey of 3,5-dibromo-N-cyclohexyl-N-ethyl-2-hydroxybenzamide?
The InChIKey is GOBHPJAZGSDEPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19Br2NO2/c1-2-18(11-6-4-3-5-7-11)15(20)12-8-10(16)9-13(17)14(12)19/h8-9,11,19H,2-7H2,1H3.
What are the key properties of 3,5-dibromo-N-cyclohexyl-N-ethyl-2-hydroxybenzamide?
3,5-dibromo-N-cyclohexyl-N-ethyl-2-hydroxybenzamide has a molecular weight of 405.13 g/mol, XLogP of 4.71, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dibromo-N-cyclohexyl-N-ethyl-2-hydroxybenzamide is sourced from PubChem (CID 154162660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).