4-cyano-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide

C18H14N2O2S — CID 163347198

IUPAC4-cyano-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide
SMILESN#Cc1ccc(C(=O)NCCc2ccc(-c3ccco3)s2)cc1
InChIInChI=1S/C18H14N2O2S/c19-12-13-3-5-14(6-4-13)18(21)20-10-9-15-7-8-17(23-15)16-2-1-11-22-16/h1-8,11H,9-10H2,(H,20,21)
InChIKeyGFEDYXMZYXXQBK-UHFFFAOYSA-N
MW322.39 g/mol
LogP3.85
Rot. Bonds5

About 4-cyano-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide

4-cyano-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide (PubChem CID 163347198) has the molecular formula C18H14N2O2S and a molecular weight of 322.39 g/mol. Its IUPAC name is 4-cyano-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide.

Molecular Properties

Compound Name4-cyano-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide
PubChem CID163347198
Molecular FormulaC18H14N2O2S
Molecular Weight322.39 g/mol
Exact Mass322.08
IUPAC Name4-cyano-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide
SMILESN#Cc1ccc(C(=O)NCCc2ccc(-c3ccco3)s2)cc1
InChIInChI=1S/C18H14N2O2S/c19-12-13-3-5-14(6-4-13)18(21)20-10-9-15-7-8-17(23-15)16-2-1-11-22-16/h1-8,11H,9-10H2,(H,20,21)
InChIKeyGFEDYXMZYXXQBK-UHFFFAOYSA-N
XLogP3.85
TPSA66.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.39
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(dimethylamino)-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide
CID 163347241
4-cyano-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzenesulfonamide
CID 163347265
2-chloro-6-fluoro-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide
CID 163347197
N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]-N'-phenyloxamide
CID 163347218
1-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]-3-thiophen-2-ylurea
CID 163347249
4-cyano-N-[6-[(4-cyanobenzoyl)amino]hexyl]benzamide
CID 137466862
4-cyano-N-[2-(1-methylpyrazol-3-yl)ethyl]benzamide
CID 104627123
4-cyano-N-[2-(3,4-dihydroxyphenyl)ethyl]benzamide
CID 78796564
4-cyano-N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]benzamide
CID 71994048
N'-(3-chloro-4-methylphenyl)-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]oxamide
CID 163347266
1-(1,3-benzodioxol-5-yl)-3-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]urea
CID 163347257
N-benzyl-4-cyano(111C)cyclohexa-1,3,5-triene-1-carboxamide
CID 177456736

Frequently Asked Questions

What is the IUPAC name of 4-cyano-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide?
The IUPAC name of 4-cyano-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide (CID 163347198) is 4-cyano-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide.
What is the SMILES notation for 4-cyano-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide?
The canonical SMILES for 4-cyano-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide is N#Cc1ccc(C(=O)NCCc2ccc(-c3ccco3)s2)cc1.
What is the InChIKey of 4-cyano-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide?
The InChIKey is GFEDYXMZYXXQBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O2S/c19-12-13-3-5-14(6-4-13)18(21)20-10-9-15-7-8-17(23-15)16-2-1-11-22-16/h1-8,11H,9-10H2,(H,20,21).
What are the key properties of 4-cyano-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide?
4-cyano-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide has a molecular weight of 322.39 g/mol, XLogP of 3.85, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyano-N-[2-[5-(furan-2-yl)thiophen-2-yl]ethyl]benzamide is sourced from PubChem (CID 163347198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).