4-bromo-N-cyclohexyl-3-hydroxy-N-(2-hydroxyethyl)benzamide

C15H20BrNO3 — CID 103956472

IUPAC4-bromo-N-cyclohexyl-3-hydroxy-N-(2-hydroxyethyl)benzamide
SMILESO=C(c1ccc(Br)c(O)c1)N(CCO)C1CCCCC1
InChIInChI=1S/C15H20BrNO3/c16-13-7-6-11(10-14(13)19)15(20)17(8-9-18)12-4-2-1-3-5-12/h6-7,10,12,18-19H,1-5,8-9H2
InChIKeyUILMCPBBRPMVRU-UHFFFAOYSA-N
MW342.23 g/mol
LogP2.92
Rot. Bonds4

About 4-bromo-N-cyclohexyl-3-hydroxy-N-(2-hydroxyethyl)benzamide

4-bromo-N-cyclohexyl-3-hydroxy-N-(2-hydroxyethyl)benzamide (PubChem CID 103956472) has the molecular formula C15H20BrNO3 and a molecular weight of 342.23 g/mol. Its IUPAC name is 4-bromo-N-cyclohexyl-3-hydroxy-N-(2-hydroxyethyl)benzamide.

Molecular Properties

Compound Name4-bromo-N-cyclohexyl-3-hydroxy-N-(2-hydroxyethyl)benzamide
PubChem CID103956472
Molecular FormulaC15H20BrNO3
Molecular Weight342.23 g/mol
Exact Mass341.06
IUPAC Name4-bromo-N-cyclohexyl-3-hydroxy-N-(2-hydroxyethyl)benzamide
SMILESO=C(c1ccc(Br)c(O)c1)N(CCO)C1CCCCC1
InChIInChI=1S/C15H20BrNO3/c16-13-7-6-11(10-14(13)19)15(20)17(8-9-18)12-4-2-1-3-5-12/h6-7,10,12,18-19H,1-5,8-9H2
InChIKeyUILMCPBBRPMVRU-UHFFFAOYSA-N
XLogP2.92
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.23
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-N,4-N-dicyclohexyl-1-N,4-N-bis(2-hydroxyethyl)benzene-1,4-dicarboxamide
CID 3317185
3-bromo-N-cyclobutyl-4-fluoro-N-(2-hydroxyethyl)benzamide
CID 102684435
3-amino-4-bromo-N-cyclopropyl-N-(2-hydroxyethyl)benzamide
CID 61095056
4-bromo-3-hydroxy-N,N-bis(2-hydroxyethyl)benzamide
CID 103957673
4-(bromomethyl)-N-cyclohexyl-N-(2-hydroxyethyl)benzamide
CID 102851284
N-(2-chloroethyl)-N-cyclohexyl-3,4-dihydroxybenzamide
CID 107728945
N-cyclopentyl-3-hydroxy-N-(2-hydroxyethyl)benzamide
CID 54994210
3-chloro-N-cyclobutyl-N-(2-hydroxyethyl)-4-iodobenzamide
CID 102685010
N-(2-chloroethyl)-N-cyclopentyl-3,4-dihydroxybenzamide
CID 107728944
4-amino-3-bromo-N-cyclobutyl-N-(3-hydroxypropyl)benzamide
CID 102861629
3-bromo-N-(2-chloroethyl)-N-cyclohexyl-4-fluorobenzamide
CID 107956554
N-cyclopentyl-N-(2-hydroxyethyl)-1H-indole-5-carboxamide
CID 63748789

Frequently Asked Questions

What is the IUPAC name of 4-bromo-N-cyclohexyl-3-hydroxy-N-(2-hydroxyethyl)benzamide?
The IUPAC name of 4-bromo-N-cyclohexyl-3-hydroxy-N-(2-hydroxyethyl)benzamide (CID 103956472) is 4-bromo-N-cyclohexyl-3-hydroxy-N-(2-hydroxyethyl)benzamide.
What is the SMILES notation for 4-bromo-N-cyclohexyl-3-hydroxy-N-(2-hydroxyethyl)benzamide?
The canonical SMILES for 4-bromo-N-cyclohexyl-3-hydroxy-N-(2-hydroxyethyl)benzamide is O=C(c1ccc(Br)c(O)c1)N(CCO)C1CCCCC1.
What is the InChIKey of 4-bromo-N-cyclohexyl-3-hydroxy-N-(2-hydroxyethyl)benzamide?
The InChIKey is UILMCPBBRPMVRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20BrNO3/c16-13-7-6-11(10-14(13)19)15(20)17(8-9-18)12-4-2-1-3-5-12/h6-7,10,12,18-19H,1-5,8-9H2.
What are the key properties of 4-bromo-N-cyclohexyl-3-hydroxy-N-(2-hydroxyethyl)benzamide?
4-bromo-N-cyclohexyl-3-hydroxy-N-(2-hydroxyethyl)benzamide has a molecular weight of 342.23 g/mol, XLogP of 2.92, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-N-cyclohexyl-3-hydroxy-N-(2-hydroxyethyl)benzamide is sourced from PubChem (CID 103956472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).