1-(3-amino-5-thiophen-3-ylthiophen-2-yl)ethanone

C10H9NOS2 — CID 2808700

IUPAC1-(3-amino-5-thiophen-3-ylthiophen-2-yl)ethanone
SMILESCC(=O)c1sc(-c2ccsc2)cc1N
InChIInChI=1S/C10H9NOS2/c1-6(12)10-8(11)4-9(14-10)7-2-3-13-5-7/h2-5H,11H2,1H3
InChIKeyPZZBZDSSWIBAIS-UHFFFAOYSA-N
MW223.32 g/mol
LogP3.26
Rot. Bonds2

About 1-(3-amino-5-thiophen-3-ylthiophen-2-yl)ethanone

1-(3-amino-5-thiophen-3-ylthiophen-2-yl)ethanone (PubChem CID 2808700) has the molecular formula C10H9NOS2 and a molecular weight of 223.32 g/mol. Its IUPAC name is 1-(3-amino-5-thiophen-3-ylthiophen-2-yl)ethanone.

Molecular Properties

Compound Name1-(3-amino-5-thiophen-3-ylthiophen-2-yl)ethanone
PubChem CID2808700
Molecular FormulaC10H9NOS2
Molecular Weight223.32 g/mol
Exact Mass223.01
IUPAC Name1-(3-amino-5-thiophen-3-ylthiophen-2-yl)ethanone
SMILESCC(=O)c1sc(-c2ccsc2)cc1N
InChIInChI=1S/C10H9NOS2/c1-6(12)10-8(11)4-9(14-10)7-2-3-13-5-7/h2-5H,11H2,1H3
InChIKeyPZZBZDSSWIBAIS-UHFFFAOYSA-N
XLogP3.26
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-amino-5-phenylthiophen-2-yl)ethanone
CID 2807849
1-(3-amino-5-methylthiophen-2-yl)ethanone
CID 18731826
ethane;1-(4-thiophen-3-ylphenyl)ethanone
CID 143391114
3-amino-5-(3-methylphenyl)thiophene-2-carboxylic acid
CID 83036382
methyl 3-amino-5-(4-iodophenyl)thiophene-2-carboxylate
CID 43155534
3-amino-5-(4-methoxyphenyl)thiophene-2-carbohydrazide
CID 7131039
1-(2-methyl-5-thiophen-3-ylfuran-3-yl)ethanone
CID 23129496
2-methyl-5-thiophen-3-ylaniline
CID 65100609
methyl 3-amino-5-(4-cyanophenyl)thiophene-2-carboxylate
CID 11994774
methyl 3-amino-5-phenylthiophene-2-carboxylate;N-(5-phenylthiophen-3-yl)acetamide
CID 158480369
methyl 2-amino-3-(5-thiophen-3-ylthiophen-2-yl)propanoate
CID 170884294
3-[(4-chloro-2,5-dimethylphenyl)sulfonylmethyl]-5-thiophen-3-ylthiophene-2-carboxylic acid
CID 58390803

Frequently Asked Questions

What is the IUPAC name of 1-(3-amino-5-thiophen-3-ylthiophen-2-yl)ethanone?
The IUPAC name of 1-(3-amino-5-thiophen-3-ylthiophen-2-yl)ethanone (CID 2808700) is 1-(3-amino-5-thiophen-3-ylthiophen-2-yl)ethanone.
What is the SMILES notation for 1-(3-amino-5-thiophen-3-ylthiophen-2-yl)ethanone?
The canonical SMILES for 1-(3-amino-5-thiophen-3-ylthiophen-2-yl)ethanone is CC(=O)c1sc(-c2ccsc2)cc1N.
What is the InChIKey of 1-(3-amino-5-thiophen-3-ylthiophen-2-yl)ethanone?
The InChIKey is PZZBZDSSWIBAIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NOS2/c1-6(12)10-8(11)4-9(14-10)7-2-3-13-5-7/h2-5H,11H2,1H3.
What are the key properties of 1-(3-amino-5-thiophen-3-ylthiophen-2-yl)ethanone?
1-(3-amino-5-thiophen-3-ylthiophen-2-yl)ethanone has a molecular weight of 223.32 g/mol, XLogP of 3.26, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-amino-5-thiophen-3-ylthiophen-2-yl)ethanone is sourced from PubChem (CID 2808700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).