5-bromo-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-hydroxybenzamide

C15H17BrN2O2S — CID 32631312

IUPAC5-bromo-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-hydroxybenzamide
SMILESCN(C)[C@@H](CNC(=O)c1cc(Br)ccc1O)c1ccsc1
InChIInChI=1S/C15H17BrN2O2S/c1-18(2)13(10-5-6-21-9-10)8-17-15(20)12-7-11(16)3-4-14(12)19/h3-7,9,13,19H,8H2,1-2H3,(H,17,20)/t13-/m0/s1
InChIKeyCLUMDIWZFNHCGH-ZDUSSCGKSA-N
MW369.28 g/mol
LogP3.25
Rot. Bonds5

About 5-bromo-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-hydroxybenzamide

5-bromo-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-hydroxybenzamide (PubChem CID 32631312) has the molecular formula C15H17BrN2O2S and a molecular weight of 369.28 g/mol. Its IUPAC name is 5-bromo-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-hydroxybenzamide.

Molecular Properties

Compound Name5-bromo-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-hydroxybenzamide
PubChem CID32631312
Molecular FormulaC15H17BrN2O2S
Molecular Weight369.28 g/mol
Exact Mass368.02
IUPAC Name5-bromo-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-hydroxybenzamide
SMILESCN(C)[C@@H](CNC(=O)c1cc(Br)ccc1O)c1ccsc1
InChIInChI=1S/C15H17BrN2O2S/c1-18(2)13(10-5-6-21-9-10)8-17-15(20)12-7-11(16)3-4-14(12)19/h3-7,9,13,19H,8H2,1-2H3,(H,17,20)/t13-/m0/s1
InChIKeyCLUMDIWZFNHCGH-ZDUSSCGKSA-N
XLogP3.25
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.28
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-bromo-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-hydroxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(dimethylamino)-2-thiophen-3-ylethyl]-3-hydroxynaphthalene-2-carboxamide
CID 42953753
2-bromo-N-[2-(dimethylamino)-2-thiophen-3-ylethyl]benzamide
CID 16931182
1-N,4-N-bis[2-(dimethylamino)-2-thiophen-3-ylethyl]benzene-1,4-dicarboxamide
CID 46592184
N-[(2S)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2,5-dimethylbenzamide
CID 42549056
N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-3,5-dimethylbenzamide
CID 42548990
N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-methylsulfonylbenzamide
CID 33090690
N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 95976208
2-(4-bromo-2-fluorophenoxy)-N-[2-(dimethylamino)-2-thiophen-3-ylethyl]acetamide
CID 43060685
N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-3-methylbenzamide
CID 42549154
N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-5-methylthiophene-2-carboxamide
CID 32630977
N'-[2-(dimethylamino)-2-thiophen-3-ylethyl]-N-ethyloxamide
CID 16932111
5-bromo-N-(2,2-dimethoxyethyl)-2-hydroxybenzamide
CID 103602044

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-hydroxybenzamide?
The IUPAC name of 5-bromo-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-hydroxybenzamide (CID 32631312) is 5-bromo-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-hydroxybenzamide.
What is the SMILES notation for 5-bromo-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-hydroxybenzamide?
The canonical SMILES for 5-bromo-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-hydroxybenzamide is CN(C)[C@@H](CNC(=O)c1cc(Br)ccc1O)c1ccsc1.
What is the InChIKey of 5-bromo-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-hydroxybenzamide?
The InChIKey is CLUMDIWZFNHCGH-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H17BrN2O2S/c1-18(2)13(10-5-6-21-9-10)8-17-15(20)12-7-11(16)3-4-14(12)19/h3-7,9,13,19H,8H2,1-2H3,(H,17,20)/t13-/m0/s1.
What are the key properties of 5-bromo-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-hydroxybenzamide?
5-bromo-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-hydroxybenzamide has a molecular weight of 369.28 g/mol, XLogP of 3.25, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-[(2R)-2-(dimethylamino)-2-thiophen-3-ylethyl]-2-hydroxybenzamide is sourced from PubChem (CID 32631312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).