(5-chlorothiophen-2-yl)-(1,3-thiazolidin-3-yl)methanone

C8H8ClNOS2 — CID 56826373

IUPAC(5-chlorothiophen-2-yl)-(1,3-thiazolidin-3-yl)methanone
SMILESO=C(c1ccc(Cl)s1)N1CCSC1
InChIInChI=1S/C8H8ClNOS2/c9-7-2-1-6(13-7)8(11)10-3-4-12-5-10/h1-2H,3-5H2
InChIKeyJZNZRZXDONSZHW-UHFFFAOYSA-N
MW233.74 g/mol
LogP2.55
Rot. Bonds1

About (5-chlorothiophen-2-yl)-(1,3-thiazolidin-3-yl)methanone

(5-chlorothiophen-2-yl)-(1,3-thiazolidin-3-yl)methanone (PubChem CID 56826373) has the molecular formula C8H8ClNOS2 and a molecular weight of 233.74 g/mol. Its IUPAC name is (5-chlorothiophen-2-yl)-(1,3-thiazolidin-3-yl)methanone.

Molecular Properties

Compound Name(5-chlorothiophen-2-yl)-(1,3-thiazolidin-3-yl)methanone
PubChem CID56826373
Molecular FormulaC8H8ClNOS2
Molecular Weight233.74 g/mol
Exact Mass232.97
IUPAC Name(5-chlorothiophen-2-yl)-(1,3-thiazolidin-3-yl)methanone
SMILESO=C(c1ccc(Cl)s1)N1CCSC1
InChIInChI=1S/C8H8ClNOS2/c9-7-2-1-6(13-7)8(11)10-3-4-12-5-10/h1-2H,3-5H2
InChIKeyJZNZRZXDONSZHW-UHFFFAOYSA-N
XLogP2.55
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.74
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]ethanone
CID 110696424
(5-chlorothiophen-2-yl)-(3,4-dihydroxypyrrolidin-1-yl)methanone
CID 106671594
(4-chlorophenyl)-[4-(5-chlorothiophene-2-carbonyl)piperazin-1-yl]methanone
CID 110802854
(4-aminopiperidin-1-yl)-(5-chlorothiophen-2-yl)methanone
CID 62276124
1-(5-chlorothiophene-2-carbonyl)-5-methylpiperidine-3-carboxylic acid
CID 122119428
(2-chlorophenyl)-(1,3-thiazolidin-3-yl)methanone
CID 122331936
(5-chlorothiophen-2-yl)-(3-methylpyrrolidin-1-yl)methanone
CID 128961505
(5-chlorothiophen-2-yl)-(4-ethylpiperazin-1-yl)methanone
CID 25236154
[4-[6-(azepan-1-yl)pyridazin-3-yl]piperazin-1-yl]-(5-chlorothiophen-2-yl)methanone
CID 122334960
(4-amino-3-methylpiperidin-1-yl)-(5-chlorothiophen-2-yl)methanone
CID 79879754
[(3R)-3-aminopyrrolidin-1-yl]-(5-chlorothiophen-2-yl)methanone
CID 81468886
(5-chlorothiophen-2-yl)-[4-(methylamino)piperidin-1-yl]methanone;hydrochloride
CID 119563647

Frequently Asked Questions

What is the IUPAC name of (5-chlorothiophen-2-yl)-(1,3-thiazolidin-3-yl)methanone?
The IUPAC name of (5-chlorothiophen-2-yl)-(1,3-thiazolidin-3-yl)methanone (CID 56826373) is (5-chlorothiophen-2-yl)-(1,3-thiazolidin-3-yl)methanone.
What is the SMILES notation for (5-chlorothiophen-2-yl)-(1,3-thiazolidin-3-yl)methanone?
The canonical SMILES for (5-chlorothiophen-2-yl)-(1,3-thiazolidin-3-yl)methanone is O=C(c1ccc(Cl)s1)N1CCSC1.
What is the InChIKey of (5-chlorothiophen-2-yl)-(1,3-thiazolidin-3-yl)methanone?
The InChIKey is JZNZRZXDONSZHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClNOS2/c9-7-2-1-6(13-7)8(11)10-3-4-12-5-10/h1-2H,3-5H2.
What are the key properties of (5-chlorothiophen-2-yl)-(1,3-thiazolidin-3-yl)methanone?
(5-chlorothiophen-2-yl)-(1,3-thiazolidin-3-yl)methanone has a molecular weight of 233.74 g/mol, XLogP of 2.55, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chlorothiophen-2-yl)-(1,3-thiazolidin-3-yl)methanone is sourced from PubChem (CID 56826373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).