N-(diphenyl-λ4-sulfanylidene)furan-2-carboxamide

C17H13NO2S — CID 5057066

IUPACN-(diphenyl-λ4-sulfanylidene)furan-2-carboxamide
SMILESO=C(N=S(c1ccccc1)c1ccccc1)c1ccco1
InChIInChI=1S/C17H13NO2S/c19-17(16-12-7-13-20-16)18-21(14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-13H
InChIKeyCLJPGLNQLWDUHD-UHFFFAOYSA-N
MW295.36 g/mol
LogP4.34
Rot. Bonds3

About N-(diphenyl-λ4-sulfanylidene)furan-2-carboxamide

N-(diphenyl-λ4-sulfanylidene)furan-2-carboxamide (PubChem CID 5057066) has the molecular formula C17H13NO2S and a molecular weight of 295.36 g/mol. Its IUPAC name is N-(diphenyl-λ4-sulfanylidene)furan-2-carboxamide.

Molecular Properties

Compound NameN-(diphenyl-λ4-sulfanylidene)furan-2-carboxamide
PubChem CID5057066
Molecular FormulaC17H13NO2S
Molecular Weight295.36 g/mol
Exact Mass295.07
IUPAC NameN-(diphenyl-λ4-sulfanylidene)furan-2-carboxamide
SMILESO=C(N=S(c1ccccc1)c1ccccc1)c1ccco1
InChIInChI=1S/C17H13NO2S/c19-17(16-12-7-13-20-16)18-21(14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-13H
InChIKeyCLJPGLNQLWDUHD-UHFFFAOYSA-N
XLogP4.34
TPSA42.57 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.36
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

zinc furan-2-carboxylic acid
CID 25022579
furan-2-carboxylic acid;gold
CID 174701575
furan-2-carboxylic acid;silver
CID 87285311
furan-2-carboxylic acid;methanol
CID 70611195
furan-2-carboxylic acid;methanamine
CID 82372767
(2Z)-2-(furan-2-yl)-2-hydroxyiminoacetic acid
CID 14556124
furan-2-yl(phosphanyl)methanone
CID 151549332
furan-2-carboxylic acid;3-phenylpropan-1-ol
CID 174709444
furan-2-carboxylic acid;furan-2,5-dicarboxylic acid
CID 158946082
cesium furan-2-carboxylate
CID 140900702
bis(furan-2-carbothioic S-acid);hydrochloride
CID 122655797
Se-(furan-2-carbonyl) furan-2-carboselenoate
CID 10967528

Frequently Asked Questions

What is the IUPAC name of N-(diphenyl-λ4-sulfanylidene)furan-2-carboxamide?
The IUPAC name of N-(diphenyl-λ4-sulfanylidene)furan-2-carboxamide (CID 5057066) is N-(diphenyl-λ4-sulfanylidene)furan-2-carboxamide.
What is the SMILES notation for N-(diphenyl-λ4-sulfanylidene)furan-2-carboxamide?
The canonical SMILES for N-(diphenyl-λ4-sulfanylidene)furan-2-carboxamide is O=C(N=S(c1ccccc1)c1ccccc1)c1ccco1.
What is the InChIKey of N-(diphenyl-λ4-sulfanylidene)furan-2-carboxamide?
The InChIKey is CLJPGLNQLWDUHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13NO2S/c19-17(16-12-7-13-20-16)18-21(14-8-3-1-4-9-14)15-10-5-2-6-11-15/h1-13H.
What are the key properties of N-(diphenyl-λ4-sulfanylidene)furan-2-carboxamide?
N-(diphenyl-λ4-sulfanylidene)furan-2-carboxamide has a molecular weight of 295.36 g/mol, XLogP of 4.34, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(diphenyl-λ4-sulfanylidene)furan-2-carboxamide is sourced from PubChem (CID 5057066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).