N-[3-(5-methylthiophen-3-yl)prop-2-enyl]acetamide

C10H13NOS — CID 169464817

IUPACN-[3-(5-methylthiophen-3-yl)prop-2-enyl]acetamide
SMILESCC(=O)NCC=Cc1csc(C)c1
InChIInChI=1S/C10H13NOS/c1-8-6-10(7-13-8)4-3-5-11-9(2)12/h3-4,6-7H,5H2,1-2H3,(H,11,12)
InChIKeyHGZUVCQWPQYSBW-UHFFFAOYSA-N
MW195.29 g/mol
LogP2.21
Rot. Bonds3

About N-[3-(5-methylthiophen-3-yl)prop-2-enyl]acetamide

N-[3-(5-methylthiophen-3-yl)prop-2-enyl]acetamide (PubChem CID 169464817) has the molecular formula C10H13NOS and a molecular weight of 195.29 g/mol. Its IUPAC name is N-[3-(5-methylthiophen-3-yl)prop-2-enyl]acetamide.

Molecular Properties

Compound NameN-[3-(5-methylthiophen-3-yl)prop-2-enyl]acetamide
PubChem CID169464817
Molecular FormulaC10H13NOS
Molecular Weight195.29 g/mol
Exact Mass195.07
IUPAC NameN-[3-(5-methylthiophen-3-yl)prop-2-enyl]acetamide
SMILESCC(=O)NCC=Cc1csc(C)c1
InChIInChI=1S/C10H13NOS/c1-8-6-10(7-13-8)4-3-5-11-9(2)12/h3-4,6-7H,5H2,1-2H3,(H,11,12)
InChIKeyHGZUVCQWPQYSBW-UHFFFAOYSA-N
XLogP2.21
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.29
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-(3,4-dimethylphenyl)prop-2-enyl]acetamide
CID 169464973
N-[3-(4-bromo-3-methylphenyl)prop-2-enyl]acetamide
CID 169466489
N-[3-[3-(hydroxymethyl)phenyl]prop-2-enyl]acetamide
CID 169465046
N-[3-(3-chloro-5-methylphenyl)prop-2-enyl]acetamide
CID 169464965
N-[3-(3,5-dimethyl-1H-pyrrol-2-yl)prop-2-enyl]acetamide
CID 169466762
N-[3-(4-amino-3,5-difluorophenyl)prop-2-enyl]acetamide
CID 169465509
4-(3-acetamidoprop-1-enyl)pyridine-2-carboxylic acid
CID 169465521
N-[4-(5-acetylthiophen-3-yl)but-3-enyl]acetamide
CID 170488258
N-[3-[5-(hydroxymethyl)-3-pyridinyl]prop-2-enyl]acetamide
CID 169465196
4-(4-bromobut-1-enyl)-2-methylthiophene
CID 79603021
N-[3-(2-methyl-3H-benzimidazol-5-yl)prop-2-enyl]acetamide
CID 169465629
N-[3-(6-methoxy-5-methyl-3-pyridinyl)prop-2-enyl]acetamide
CID 169465538

Frequently Asked Questions

What is the IUPAC name of N-[3-(5-methylthiophen-3-yl)prop-2-enyl]acetamide?
The IUPAC name of N-[3-(5-methylthiophen-3-yl)prop-2-enyl]acetamide (CID 169464817) is N-[3-(5-methylthiophen-3-yl)prop-2-enyl]acetamide.
What is the SMILES notation for N-[3-(5-methylthiophen-3-yl)prop-2-enyl]acetamide?
The canonical SMILES for N-[3-(5-methylthiophen-3-yl)prop-2-enyl]acetamide is CC(=O)NCC=Cc1csc(C)c1.
What is the InChIKey of N-[3-(5-methylthiophen-3-yl)prop-2-enyl]acetamide?
The InChIKey is HGZUVCQWPQYSBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NOS/c1-8-6-10(7-13-8)4-3-5-11-9(2)12/h3-4,6-7H,5H2,1-2H3,(H,11,12).
What are the key properties of N-[3-(5-methylthiophen-3-yl)prop-2-enyl]acetamide?
N-[3-(5-methylthiophen-3-yl)prop-2-enyl]acetamide has a molecular weight of 195.29 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(5-methylthiophen-3-yl)prop-2-enyl]acetamide is sourced from PubChem (CID 169464817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).