N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide

C14H14N2O3S — CID 60704601

IUPACN-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)NC1C=CS(=O)(=O)C1
InChIInChI=1S/C14H14N2O3S/c17-14(16-11-5-6-20(18,19)9-11)7-10-8-15-13-4-2-1-3-12(10)13/h1-6,8,11,15H,7,9H2,(H,16,17)
InChIKeyXBJTVOANSFYVRJ-UHFFFAOYSA-N
MW290.34 g/mol
LogP1.14
Rot. Bonds3

About N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide

N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide (PubChem CID 60704601) has the molecular formula C14H14N2O3S and a molecular weight of 290.34 g/mol. Its IUPAC name is N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide
PubChem CID60704601
Molecular FormulaC14H14N2O3S
Molecular Weight290.34 g/mol
Exact Mass290.07
IUPAC NameN-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide
SMILESO=C(Cc1c[nH]c2ccccc12)NC1C=CS(=O)(=O)C1
InChIInChI=1S/C14H14N2O3S/c17-14(16-11-5-6-20(18,19)9-11)7-10-8-15-13-4-2-1-3-12(10)13/h1-6,8,11,15H,7,9H2,(H,16,17)
InChIKeyXBJTVOANSFYVRJ-UHFFFAOYSA-N
XLogP1.14
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.34
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide 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-(3-azabicyclo[3.1.0]hexan-6-yl)-2-(1H-indol-3-yl)acetamide
CID 43594469
N-hydroxy-2-(1H-indol-3-yl)acetamide
CID 13058633
N-cyclopentyloxy-2-(1H-indol-3-yl)acetamide
CID 83202752
2-(1H-indol-3-yl)-N-(3-tricyclo[3.2.1.02,4]octanyl)acetamide
CID 103767102
2-(1H-indol-3-yl)-N-(3-methoxycyclobutyl)acetamide
CID 104578428
[2-[[(3R)-1,1-dioxothiolan-3-yl]amino]-2-oxoethyl] 2-(1H-indol-3-yl)acetate
CID 40609388
N-(3,4-dimethylcyclohexyl)-2-(1H-indol-3-yl)acetamide
CID 64742201
N-[2-(cyclopentylamino)-2-oxoethyl]-2-(1H-indol-3-yl)acetamide
CID 112990882
N-cyclopropyl-3-[[2-(1H-indol-3-yl)acetyl]amino]propanamide
CID 79382425
hydroxylamine;6-[[2-(1H-indol-3-yl)acetyl]amino]hexanoic acid
CID 70007907
N'-[2-(1H-indol-3-yl)acetyl]cyclobutanecarbohydrazide
CID 29437842
N-[4-(cyclopropanecarbonyl)phenyl]-2-(1H-indol-3-yl)acetamide
CID 110604202

Frequently Asked Questions

What is the IUPAC name of N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide?
The IUPAC name of N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide (CID 60704601) is N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide.
What is the SMILES notation for N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide?
The canonical SMILES for N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide is O=C(Cc1c[nH]c2ccccc12)NC1C=CS(=O)(=O)C1.
What is the InChIKey of N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide?
The InChIKey is XBJTVOANSFYVRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O3S/c17-14(16-11-5-6-20(18,19)9-11)7-10-8-15-13-4-2-1-3-12(10)13/h1-6,8,11,15H,7,9H2,(H,16,17).
What are the key properties of N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide?
N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide has a molecular weight of 290.34 g/mol, XLogP of 1.14, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)-2-(1H-indol-3-yl)acetamide is sourced from PubChem (CID 60704601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).