N-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide

C14H17NO4S2 — CID 7268311

IUPACN-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide
SMILESCCCC(=O)NC[C@H](c1ccco1)S(=O)(=O)c1cccs1
InChIInChI=1S/C14H17NO4S2/c1-2-5-13(16)15-10-12(11-6-3-8-19-11)21(17,18)14-7-4-9-20-14/h3-4,6-9,12H,2,5,10H2,1H3,(H,15,16)/t12-/m1/s1
InChIKeyXXFNUIVEUFYSBH-GFCCVEGCSA-N
MW327.43 g/mol
LogP2.77
Rot. Bonds7

About N-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide

N-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide (PubChem CID 7268311) has the molecular formula C14H17NO4S2 and a molecular weight of 327.43 g/mol. Its IUPAC name is N-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide.

Molecular Properties

Compound NameN-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide
PubChem CID7268311
Molecular FormulaC14H17NO4S2
Molecular Weight327.43 g/mol
Exact Mass327.06
IUPAC NameN-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide
SMILESCCCC(=O)NC[C@H](c1ccco1)S(=O)(=O)c1cccs1
InChIInChI=1S/C14H17NO4S2/c1-2-5-13(16)15-10-12(11-6-3-8-19-11)21(17,18)14-7-4-9-20-14/h3-4,6-9,12H,2,5,10H2,1H3,(H,15,16)/t12-/m1/s1
InChIKeyXXFNUIVEUFYSBH-GFCCVEGCSA-N
XLogP2.77
TPSA76.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2S)-2-(4-methoxyphenyl)-2-thiophen-2-ylsulfonylethyl]butanamide
CID 9182900
N-[2-(dimethylamino)ethyl]-N'-[2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]oxamide
CID 22584641
4-chloro-N-[(2S)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]benzamide
CID 7268351
N'-cyclopropyl-N-[2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]oxamide
CID 22584668
1-cyclohexyl-3-[2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]urea
CID 110315206
N'-[(2S)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]-N-(pyridin-2-ylmethyl)oxamide
CID 27569543
N-[(4-fluorophenyl)methyl]-N'-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]oxamide
CID 40778166
N'-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]-N-[(2-methoxyphenyl)methyl]oxamide
CID 40775052
N'-[(2S)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]-N-(3-phenylpropyl)oxamide
CID 27558122
N'-cyclohexyl-N-[2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]oxamide
CID 22584643
N'-cyclohexyl-N-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]oxamide
CID 7268303
N-[(2S)-2-(furan-2-yl)-2-methoxyethyl]butanamide
CID 99876283

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide?
The IUPAC name of N-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide (CID 7268311) is N-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide.
What is the SMILES notation for N-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide?
The canonical SMILES for N-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide is CCCC(=O)NC[C@H](c1ccco1)S(=O)(=O)c1cccs1.
What is the InChIKey of N-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide?
The InChIKey is XXFNUIVEUFYSBH-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H17NO4S2/c1-2-5-13(16)15-10-12(11-6-3-8-19-11)21(17,18)14-7-4-9-20-14/h3-4,6-9,12H,2,5,10H2,1H3,(H,15,16)/t12-/m1/s1.
What are the key properties of N-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide?
N-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide has a molecular weight of 327.43 g/mol, XLogP of 2.77, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(furan-2-yl)-2-thiophen-2-ylsulfonylethyl]butanamide is sourced from PubChem (CID 7268311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).