N-(2-bromoprop-2-enyl)-5-methylthiophene-3-carboxamide

C9H10BrNOS — CID 130610492

IUPACN-(2-bromoprop-2-enyl)-5-methylthiophene-3-carboxamide
SMILESC=C(Br)CNC(=O)c1csc(C)c1
InChIInChI=1S/C9H10BrNOS/c1-6(10)4-11-9(12)8-3-7(2)13-5-8/h3,5H,1,4H2,2H3,(H,11,12)
InChIKeyXCZZBMVTDYIJSN-UHFFFAOYSA-N
MW260.16 g/mol
LogP2.69
Rot. Bonds3

About N-(2-bromoprop-2-enyl)-5-methylthiophene-3-carboxamide

N-(2-bromoprop-2-enyl)-5-methylthiophene-3-carboxamide (PubChem CID 130610492) has the molecular formula C9H10BrNOS and a molecular weight of 260.16 g/mol. Its IUPAC name is N-(2-bromoprop-2-enyl)-5-methylthiophene-3-carboxamide.

Molecular Properties

Compound NameN-(2-bromoprop-2-enyl)-5-methylthiophene-3-carboxamide
PubChem CID130610492
Molecular FormulaC9H10BrNOS
Molecular Weight260.16 g/mol
Exact Mass258.97
IUPAC NameN-(2-bromoprop-2-enyl)-5-methylthiophene-3-carboxamide
SMILESC=C(Br)CNC(=O)c1csc(C)c1
InChIInChI=1S/C9H10BrNOS/c1-6(10)4-11-9(12)8-3-7(2)13-5-8/h3,5H,1,4H2,2H3,(H,11,12)
InChIKeyXCZZBMVTDYIJSN-UHFFFAOYSA-N
XLogP2.69
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.16
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-bromo-N-(2-bromoprop-2-enyl)thiophene-3-carboxamide
CID 115594394
N-(2-bromoprop-2-enyl)-5-methylfuran-3-carboxamide
CID 114821704
N-(2-bromoprop-2-enyl)-2,5-dimethylthiophene-3-carboxamide
CID 47439097
N-(2-bromoprop-2-enyl)-2,6-dimethylbenzamide
CID 103769141
N'-acetyl-5-methylthiophene-3-carbohydrazide
CID 131134139
N-(2-bromoprop-2-enyl)-3-methyl-1,2-thiazole-4-carboxamide
CID 131207229
N-[(3-chlorophenyl)methyl]-5-methylthiophene-3-carboxamide
CID 1246739
N-[2-(2-bromoprop-2-enylamino)-2-oxoethyl]-5-methylthiophene-2-carboxamide
CID 47439179
N-(2-bromoprop-2-enyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 115594716
4-(bromomethyl)-N-(2-bromoprop-2-enyl)benzamide
CID 102852072
N-(2-bromoprop-2-enyl)-2,3-dimethylbenzamide
CID 115594477
N-(2-cyanopropan-2-yl)-5-methylthiophene-3-carboxamide
CID 131115004

Frequently Asked Questions

What is the IUPAC name of N-(2-bromoprop-2-enyl)-5-methylthiophene-3-carboxamide?
The IUPAC name of N-(2-bromoprop-2-enyl)-5-methylthiophene-3-carboxamide (CID 130610492) is N-(2-bromoprop-2-enyl)-5-methylthiophene-3-carboxamide.
What is the SMILES notation for N-(2-bromoprop-2-enyl)-5-methylthiophene-3-carboxamide?
The canonical SMILES for N-(2-bromoprop-2-enyl)-5-methylthiophene-3-carboxamide is C=C(Br)CNC(=O)c1csc(C)c1.
What is the InChIKey of N-(2-bromoprop-2-enyl)-5-methylthiophene-3-carboxamide?
The InChIKey is XCZZBMVTDYIJSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrNOS/c1-6(10)4-11-9(12)8-3-7(2)13-5-8/h3,5H,1,4H2,2H3,(H,11,12).
What are the key properties of N-(2-bromoprop-2-enyl)-5-methylthiophene-3-carboxamide?
N-(2-bromoprop-2-enyl)-5-methylthiophene-3-carboxamide has a molecular weight of 260.16 g/mol, XLogP of 2.69, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-bromoprop-2-enyl)-5-methylthiophene-3-carboxamide is sourced from PubChem (CID 130610492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).