(2-propyl-1,3-thiazolidin-3-yl)-thiophen-2-ylmethanone

C11H15NOS2 — CID 122140873

IUPAC(2-propyl-1,3-thiazolidin-3-yl)-thiophen-2-ylmethanone
SMILESCCCC1SCCN1C(=O)c1cccs1
InChIInChI=1S/C11H15NOS2/c1-2-4-10-12(6-8-15-10)11(13)9-5-3-7-14-9/h3,5,7,10H,2,4,6,8H2,1H3
InChIKeyYHHCHMMNVIQFSQ-UHFFFAOYSA-N
MW241.38 g/mol
LogP3.06
Rot. Bonds3

About (2-propyl-1,3-thiazolidin-3-yl)-thiophen-2-ylmethanone

(2-propyl-1,3-thiazolidin-3-yl)-thiophen-2-ylmethanone (PubChem CID 122140873) has the molecular formula C11H15NOS2 and a molecular weight of 241.38 g/mol. Its IUPAC name is (2-propyl-1,3-thiazolidin-3-yl)-thiophen-2-ylmethanone.

Molecular Properties

Compound Name(2-propyl-1,3-thiazolidin-3-yl)-thiophen-2-ylmethanone
PubChem CID122140873
Molecular FormulaC11H15NOS2
Molecular Weight241.38 g/mol
Exact Mass241.06
IUPAC Name(2-propyl-1,3-thiazolidin-3-yl)-thiophen-2-ylmethanone
SMILESCCCC1SCCN1C(=O)c1cccs1
InChIInChI=1S/C11H15NOS2/c1-2-4-10-12(6-8-15-10)11(13)9-5-3-7-14-9/h3,5,7,10H,2,4,6,8H2,1H3
InChIKeyYHHCHMMNVIQFSQ-UHFFFAOYSA-N
XLogP3.06
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3-hydroxy-2-pyridinyl)-(2-propyl-1,3-thiazolidin-3-yl)methanone
CID 86792334
[2-(5-methylthiophen-2-yl)-1,3-thiazolidin-3-yl]-thiophen-2-ylmethanone
CID 3630788
[(2S)-2-(5-methylthiophen-2-yl)-1,3-thiazolidin-3-yl]-thiophen-2-ylmethanone
CID 7347840
(3-ethylsulfonylthiomorpholin-4-yl)-thiophen-2-ylmethanone
CID 66375654
[2-(4-propan-2-ylphenyl)-1,3-thiazolidin-3-yl]-thiophen-2-ylmethanone
CID 42781134
[(2R)-2-(furan-2-yl)-1,3-thiazolidin-3-yl]-thiophen-2-ylmethanone
CID 7249262
2-(2-propyl-1,3-thiazolidine-3-carbonyl)chromen-4-one
CID 71875375
thiophen-2-yl-[(2S)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]methanone
CID 815293
[(2R)-2-(3,4-dichlorophenyl)-1,3-thiazolidin-3-yl]-thiophen-2-ylmethanone
CID 99985881
[(2S)-2-methylpiperazin-1-yl]-thiophen-2-ylmethanone
CID 82705304
[(2R)-2-methylpiperazin-1-yl]-thiophen-2-ylmethanone
CID 82705008
[(2R)-2-(3-fluorophenyl)-1,3-thiazolidin-3-yl]-thiophen-2-ylmethanone
CID 7364549

Frequently Asked Questions

What is the IUPAC name of (2-propyl-1,3-thiazolidin-3-yl)-thiophen-2-ylmethanone?
The IUPAC name of (2-propyl-1,3-thiazolidin-3-yl)-thiophen-2-ylmethanone (CID 122140873) is (2-propyl-1,3-thiazolidin-3-yl)-thiophen-2-ylmethanone.
What is the SMILES notation for (2-propyl-1,3-thiazolidin-3-yl)-thiophen-2-ylmethanone?
The canonical SMILES for (2-propyl-1,3-thiazolidin-3-yl)-thiophen-2-ylmethanone is CCCC1SCCN1C(=O)c1cccs1.
What is the InChIKey of (2-propyl-1,3-thiazolidin-3-yl)-thiophen-2-ylmethanone?
The InChIKey is YHHCHMMNVIQFSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NOS2/c1-2-4-10-12(6-8-15-10)11(13)9-5-3-7-14-9/h3,5,7,10H,2,4,6,8H2,1H3.
What are the key properties of (2-propyl-1,3-thiazolidin-3-yl)-thiophen-2-ylmethanone?
(2-propyl-1,3-thiazolidin-3-yl)-thiophen-2-ylmethanone has a molecular weight of 241.38 g/mol, XLogP of 3.06, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2-propyl-1,3-thiazolidin-3-yl)-thiophen-2-ylmethanone is sourced from PubChem (CID 122140873), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).