N-(2-ethylsulfanylphenyl)-2-thiophen-2-ylacetamide

C14H15NOS2 — CID 94624110

IUPACN-(2-ethylsulfanylphenyl)-2-thiophen-2-ylacetamide
SMILESCCSc1ccccc1NC(=O)Cc1cccs1
InChIInChI=1S/C14H15NOS2/c1-2-17-13-8-4-3-7-12(13)15-14(16)10-11-6-5-9-18-11/h3-9H,2,10H2,1H3,(H,15,16)
InChIKeyDOWTXJKBHQNXJV-UHFFFAOYSA-N
MW277.41 g/mol
LogP4.04
Rot. Bonds5

About N-(2-ethylsulfanylphenyl)-2-thiophen-2-ylacetamide

N-(2-ethylsulfanylphenyl)-2-thiophen-2-ylacetamide (PubChem CID 94624110) has the molecular formula C14H15NOS2 and a molecular weight of 277.41 g/mol. Its IUPAC name is N-(2-ethylsulfanylphenyl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(2-ethylsulfanylphenyl)-2-thiophen-2-ylacetamide
PubChem CID94624110
Molecular FormulaC14H15NOS2
Molecular Weight277.41 g/mol
Exact Mass277.06
IUPAC NameN-(2-ethylsulfanylphenyl)-2-thiophen-2-ylacetamide
SMILESCCSc1ccccc1NC(=O)Cc1cccs1
InChIInChI=1S/C14H15NOS2/c1-2-17-13-8-4-3-7-12(13)15-14(16)10-11-6-5-9-18-11/h3-9H,2,10H2,1H3,(H,15,16)
InChIKeyDOWTXJKBHQNXJV-UHFFFAOYSA-N
XLogP4.04
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-acetamidophenyl)-2-thiophen-2-ylacetamide
CID 1363852
N-(2-hydroxyphenyl)-2-thiophen-2-ylacetamide
CID 837925
N-[2-[(2S)-butan-2-yl]phenyl]-2-thiophen-2-ylacetamide
CID 7299999
N-(2-ethylsulfanylphenyl)but-3-enamide
CID 162691877
[2-(2-methylsulfanylanilino)-2-oxoethyl]-bis(thiophen-2-ylmethyl)azanium
CID 8800916
4-chloro-N-[2-[(2-thiophen-2-ylacetyl)amino]phenyl]benzamide
CID 31970330
N-[2-(3-amino-3-oxopropyl)sulfanylphenyl]-4-thiophen-2-ylbutanamide
CID 56826258
N-(1-aminoethyl)-2-thiophen-2-ylacetamide
CID 173143442
N-[2-[(2-benzyl-5-chloro-1,2,4-triazol-3-yl)sulfanyl]phenyl]-2-thiophen-2-ylacetamide
CID 46249678
ethyl 4-(2-ethylsulfanylanilino)-4-oxobutanoate
CID 61061323
N-(2-ethylsulfanylphenyl)-2-(4-methylphenyl)sulfanylacetamide
CID 46763178
2,2-diethyl-4-(2-ethylsulfanylanilino)-4-oxobutanoic acid
CID 60933601

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylsulfanylphenyl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(2-ethylsulfanylphenyl)-2-thiophen-2-ylacetamide (CID 94624110) is N-(2-ethylsulfanylphenyl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(2-ethylsulfanylphenyl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(2-ethylsulfanylphenyl)-2-thiophen-2-ylacetamide is CCSc1ccccc1NC(=O)Cc1cccs1.
What is the InChIKey of N-(2-ethylsulfanylphenyl)-2-thiophen-2-ylacetamide?
The InChIKey is DOWTXJKBHQNXJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NOS2/c1-2-17-13-8-4-3-7-12(13)15-14(16)10-11-6-5-9-18-11/h3-9H,2,10H2,1H3,(H,15,16).
What are the key properties of N-(2-ethylsulfanylphenyl)-2-thiophen-2-ylacetamide?
N-(2-ethylsulfanylphenyl)-2-thiophen-2-ylacetamide has a molecular weight of 277.41 g/mol, XLogP of 4.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylsulfanylphenyl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 94624110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).