2-(5-bromothiophen-2-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide

C14H14BrNO2S — CID 111335516

IUPAC2-(5-bromothiophen-2-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide
SMILESO=C(Cc1ccc(Br)s1)Nc1ccc(CCO)cc1
InChIInChI=1S/C14H14BrNO2S/c15-13-6-5-12(19-13)9-14(18)16-11-3-1-10(2-4-11)7-8-17/h1-6,17H,7-9H2,(H,16,18)
InChIKeyOAXHTKZTPDDJIY-UHFFFAOYSA-N
MW340.24 g/mol
LogP3.23
Rot. Bonds5

About 2-(5-bromothiophen-2-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide

2-(5-bromothiophen-2-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide (PubChem CID 111335516) has the molecular formula C14H14BrNO2S and a molecular weight of 340.24 g/mol. Its IUPAC name is 2-(5-bromothiophen-2-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(5-bromothiophen-2-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide
PubChem CID111335516
Molecular FormulaC14H14BrNO2S
Molecular Weight340.24 g/mol
Exact Mass338.99
IUPAC Name2-(5-bromothiophen-2-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide
SMILESO=C(Cc1ccc(Br)s1)Nc1ccc(CCO)cc1
InChIInChI=1S/C14H14BrNO2S/c15-13-6-5-12(19-13)9-14(18)16-11-3-1-10(2-4-11)7-8-17/h1-6,17H,7-9H2,(H,16,18)
InChIKeyOAXHTKZTPDDJIY-UHFFFAOYSA-N
XLogP3.23
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.24
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[4-[[2-(5-bromothiophen-2-yl)acetyl]amino]phenyl]-2-methylpropanoic acid
CID 120541133
5-bromo-N-[4-(2-hydroxyethyl)phenyl]thiophene-2-carboxamide
CID 61222679
2-(2,6-dichlorophenyl)-N-[4-(2-hydroxyethyl)phenyl]acetamide
CID 51985201
3-amino-N-[4-(2-hydroxyethyl)phenyl]-3-sulfanylidenepropanamide
CID 61236630
N-[4-(2-hydroxyethyl)phenyl]acetamide
CID 3295905
2-(4-bromophenoxy)-N-[4-(2-hydroxyethyl)phenyl]acetamide
CID 55989555
5-bromo-N-[4-(2-hydroxyethyl)phenyl]-4-methylthiophene-2-carboxamide
CID 79989970
2-anilino-N-[4-(2-hydroxyethyl)phenyl]acetamide
CID 61237525
N-[4-(2-hydroxyethoxy)phenyl]-2-(5-methylthiophen-2-yl)acetamide
CID 111116175
2-(3,5-dimethyl-1H-pyrazol-4-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide
CID 61221604
N-[4-(2-bromoethyl)phenyl]-2-phenylacetamide
CID 114310172
2-(5-bromothiophen-2-yl)-N-(4-hydroxy-2-methylpentyl)acetamide
CID 111447118

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromothiophen-2-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide?
The IUPAC name of 2-(5-bromothiophen-2-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide (CID 111335516) is 2-(5-bromothiophen-2-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide.
What is the SMILES notation for 2-(5-bromothiophen-2-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide?
The canonical SMILES for 2-(5-bromothiophen-2-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide is O=C(Cc1ccc(Br)s1)Nc1ccc(CCO)cc1.
What is the InChIKey of 2-(5-bromothiophen-2-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide?
The InChIKey is OAXHTKZTPDDJIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14BrNO2S/c15-13-6-5-12(19-13)9-14(18)16-11-3-1-10(2-4-11)7-8-17/h1-6,17H,7-9H2,(H,16,18).
What are the key properties of 2-(5-bromothiophen-2-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide?
2-(5-bromothiophen-2-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide has a molecular weight of 340.24 g/mol, XLogP of 3.23, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-bromothiophen-2-yl)-N-[4-(2-hydroxyethyl)phenyl]acetamide is sourced from PubChem (CID 111335516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).