N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide

C19H15NO3S — CID 24686991

IUPACN-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide
SMILESO=C(c1cc2ccccc2o1)N(Cc1ccco1)Cc1cccs1
InChIInChI=1S/C19H15NO3S/c21-19(18-11-14-5-1-2-8-17(14)23-18)20(12-15-6-3-9-22-15)13-16-7-4-10-24-16/h1-11H,12-13H2
InChIKeyYLGIARPCMDOBDE-UHFFFAOYSA-N
MW337.40 g/mol
LogP4.93
Rot. Bonds5

About N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide

N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide (PubChem CID 24686991) has the molecular formula C19H15NO3S and a molecular weight of 337.40 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide
PubChem CID24686991
Molecular FormulaC19H15NO3S
Molecular Weight337.40 g/mol
Exact Mass337.08
IUPAC NameN-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide
SMILESO=C(c1cc2ccccc2o1)N(Cc1ccco1)Cc1cccs1
InChIInChI=1S/C19H15NO3S/c21-19(18-11-14-5-1-2-8-17(14)23-18)20(12-15-6-3-9-22-15)13-16-7-4-10-24-16/h1-11H,12-13H2
InChIKeyYLGIARPCMDOBDE-UHFFFAOYSA-N
XLogP4.93
TPSA46.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.40
LogP ≤ 54.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(2-Furylmethyl)-3-HO-5-PH-4-(2-thienylcarbonyl)-1,5-dihydro-2H-pyrrol-2-one
CID 2934282
N-(1,1-dioxidotetrahydrothiophen-3-yl)-3-methyl-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide
CID 662750
N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide
CID 2675152
N-ethyl-5-methyl-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide
CID 67511180
N-ethyl-5-methoxy-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide
CID 67512362
N-(2-furanylmethyl)-2-benzofurancarboxamide
CID 675184
Furan-2-yl-[4-(3-phenylthiophene-2-carbonyl)piperazin-1-yl]methanone
CID 2496667
5-bromo-3-methyl-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide
CID 2498342
1-Benzofuran-2-yl-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone
CID 2550616
2-{[4-(2-furoyl)piperazin-1-yl]carbonyl}-4H-thieno[3,2-c]chromen-4-one
CID 3239573
N-[1-(thiophen-2-yl)ethyl]-1-benzofuran-2-carboxamide
CID 3244519
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-1-benzofuran-2-carboxamide;hydrochloride
CID 6603526

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide (CID 24686991) is N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide is O=C(c1cc2ccccc2o1)N(Cc1ccco1)Cc1cccs1.
What is the InChIKey of N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide?
The InChIKey is YLGIARPCMDOBDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NO3S/c21-19(18-11-14-5-1-2-8-17(14)23-18)20(12-15-6-3-9-22-15)13-16-7-4-10-24-16/h1-11H,12-13H2.
What are the key properties of N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide?
N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide has a molecular weight of 337.40 g/mol, XLogP of 4.93, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-N-(thiophen-2-ylmethyl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 24686991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).