N-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide

C23H17F2NO5S — CID 31523225

IUPACN-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(S(=O)(=O)C(F)F)cc1)c1ccc(COc2ccc3ccccc3c2)o1
InChIInChI=1S/C23H17F2NO5S/c24-23(25)32(28,29)20-10-6-17(7-11-20)26-22(27)21-12-9-19(31-21)14-30-18-8-5-15-3-1-2-4-16(15)13-18/h1-13,23H,14H2,(H,26,27)
InChIKeyPGHULUJSIVMEHV-UHFFFAOYSA-N
MW457.45 g/mol
LogP5.26
Rot. Bonds7

About N-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide

N-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide (PubChem CID 31523225) has the molecular formula C23H17F2NO5S and a molecular weight of 457.45 g/mol. Its IUPAC name is N-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
PubChem CID31523225
Molecular FormulaC23H17F2NO5S
Molecular Weight457.45 g/mol
Exact Mass457.08
IUPAC NameN-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(S(=O)(=O)C(F)F)cc1)c1ccc(COc2ccc3ccccc3c2)o1
InChIInChI=1S/C23H17F2NO5S/c24-23(25)32(28,29)20-10-6-17(7-11-20)26-22(27)21-12-9-19(31-21)14-30-18-8-5-15-3-1-2-4-16(15)13-18/h1-13,23H,14H2,(H,26,27)
InChIKeyPGHULUJSIVMEHV-UHFFFAOYSA-N
XLogP5.26
TPSA85.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500457.45
LogP ≤ 55.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-hydroxyphenyl)-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 19460984
5-(naphthalen-2-yloxymethyl)-N-pyridin-3-ylfuran-2-carboxamide
CID 717197
N-[3-(cyanomethoxy)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 55800345
5-(naphthalen-2-yloxymethyl)-N-[2-(trifluoromethyl)phenyl]furan-2-carboxamide
CID 19460989
5-(naphthalen-2-yloxymethyl)-N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide
CID 55345719
5-[(4-fluorophenoxy)methyl]-N-(4-phenylphenyl)furan-2-carboxamide
CID 19413095
N-[2-methyl-5-(2-methylpropanoylamino)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 46466062
N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 19460996
5-[(3,4-dimethylphenoxy)methyl]-N-phenylfuran-2-carboxamide
CID 19450839
N-(furan-2-ylmethyl)-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 19461074
N-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]-5-[(3-methylphenoxy)methyl]furan-2-carboxamide
CID 19465565
N-[[3-(furan-2-carbonylamino)phenyl]methyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 46401322

Frequently Asked Questions

What is the IUPAC name of N-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide?
The IUPAC name of N-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide (CID 31523225) is N-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide.
What is the SMILES notation for N-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide?
The canonical SMILES for N-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide is O=C(Nc1ccc(S(=O)(=O)C(F)F)cc1)c1ccc(COc2ccc3ccccc3c2)o1.
What is the InChIKey of N-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide?
The InChIKey is PGHULUJSIVMEHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H17F2NO5S/c24-23(25)32(28,29)20-10-6-17(7-11-20)26-22(27)21-12-9-19(31-21)14-30-18-8-5-15-3-1-2-4-16(15)13-18/h1-13,23H,14H2,(H,26,27).
What are the key properties of N-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide?
N-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide has a molecular weight of 457.45 g/mol, XLogP of 5.26, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide is sourced from PubChem (CID 31523225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).