2-(furan-2-ylmethylsulfanyl)-N-(1-thiophen-2-ylpropan-2-yl)acetamide

C14H17NO2S2 — CID 46961399

IUPAC2-(furan-2-ylmethylsulfanyl)-N-(1-thiophen-2-ylpropan-2-yl)acetamide
SMILESCC(Cc1cccs1)NC(=O)CSCc1ccco1
InChIInChI=1S/C14H17NO2S2/c1-11(8-13-5-3-7-19-13)15-14(16)10-18-9-12-4-2-6-17-12/h2-7,11H,8-10H2,1H3,(H,15,16)
InChIKeyQCCCYFORCKNNMV-UHFFFAOYSA-N
MW295.43 g/mol
LogP3.32
Rot. Bonds7

About 2-(furan-2-ylmethylsulfanyl)-N-(1-thiophen-2-ylpropan-2-yl)acetamide

2-(furan-2-ylmethylsulfanyl)-N-(1-thiophen-2-ylpropan-2-yl)acetamide (PubChem CID 46961399) has the molecular formula C14H17NO2S2 and a molecular weight of 295.43 g/mol. Its IUPAC name is 2-(furan-2-ylmethylsulfanyl)-N-(1-thiophen-2-ylpropan-2-yl)acetamide.

Molecular Properties

Compound Name2-(furan-2-ylmethylsulfanyl)-N-(1-thiophen-2-ylpropan-2-yl)acetamide
PubChem CID46961399
Molecular FormulaC14H17NO2S2
Molecular Weight295.43 g/mol
Exact Mass295.07
IUPAC Name2-(furan-2-ylmethylsulfanyl)-N-(1-thiophen-2-ylpropan-2-yl)acetamide
SMILESCC(Cc1cccs1)NC(=O)CSCc1ccco1
InChIInChI=1S/C14H17NO2S2/c1-11(8-13-5-3-7-19-13)15-14(16)10-18-9-12-4-2-6-17-12/h2-7,11H,8-10H2,1H3,(H,15,16)
InChIKeyQCCCYFORCKNNMV-UHFFFAOYSA-N
XLogP3.32
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.43
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-ylmethylsulfanyl)-N-(1-thiophen-2-ylpropan-2-yl)acetamide?
The IUPAC name of 2-(furan-2-ylmethylsulfanyl)-N-(1-thiophen-2-ylpropan-2-yl)acetamide (CID 46961399) is 2-(furan-2-ylmethylsulfanyl)-N-(1-thiophen-2-ylpropan-2-yl)acetamide.
What is the SMILES notation for 2-(furan-2-ylmethylsulfanyl)-N-(1-thiophen-2-ylpropan-2-yl)acetamide?
The canonical SMILES for 2-(furan-2-ylmethylsulfanyl)-N-(1-thiophen-2-ylpropan-2-yl)acetamide is CC(Cc1cccs1)NC(=O)CSCc1ccco1.
What is the InChIKey of 2-(furan-2-ylmethylsulfanyl)-N-(1-thiophen-2-ylpropan-2-yl)acetamide?
The InChIKey is QCCCYFORCKNNMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO2S2/c1-11(8-13-5-3-7-19-13)15-14(16)10-18-9-12-4-2-6-17-12/h2-7,11H,8-10H2,1H3,(H,15,16).
What are the key properties of 2-(furan-2-ylmethylsulfanyl)-N-(1-thiophen-2-ylpropan-2-yl)acetamide?
2-(furan-2-ylmethylsulfanyl)-N-(1-thiophen-2-ylpropan-2-yl)acetamide has a molecular weight of 295.43 g/mol, XLogP of 3.32, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-ylmethylsulfanyl)-N-(1-thiophen-2-ylpropan-2-yl)acetamide is sourced from PubChem (CID 46961399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).