5-(naphthalen-2-yloxymethyl)-N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide

C24H22N2O5S — CID 55345719

IUPAC5-(naphthalen-2-yloxymethyl)-N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)c2ccc(COc3ccc4ccccc4c3)o2)cc1
InChIInChI=1S/C24H22N2O5S/c25-32(28,29)22-10-5-17(6-11-22)13-14-26-24(27)23-12-9-21(31-23)16-30-20-8-7-18-3-1-2-4-19(18)15-20/h1-12,15H,13-14,16H2,(H,26,27)(H2,25,28,29)
InChIKeyZAABBJOTWUKKAU-UHFFFAOYSA-N
MW450.52 g/mol
LogP3.63
Rot. Bonds8

About 5-(naphthalen-2-yloxymethyl)-N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide

5-(naphthalen-2-yloxymethyl)-N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide (PubChem CID 55345719) has the molecular formula C24H22N2O5S and a molecular weight of 450.52 g/mol. Its IUPAC name is 5-(naphthalen-2-yloxymethyl)-N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-(naphthalen-2-yloxymethyl)-N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide
PubChem CID55345719
Molecular FormulaC24H22N2O5S
Molecular Weight450.52 g/mol
Exact Mass450.12
IUPAC Name5-(naphthalen-2-yloxymethyl)-N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide
SMILESNS(=O)(=O)c1ccc(CCNC(=O)c2ccc(COc3ccc4ccccc4c3)o2)cc1
InChIInChI=1S/C24H22N2O5S/c25-32(28,29)22-10-5-17(6-11-22)13-14-26-24(27)23-12-9-21(31-23)16-30-20-8-7-18-3-1-2-4-19(18)15-20/h1-12,15H,13-14,16H2,(H,26,27)(H2,25,28,29)
InChIKeyZAABBJOTWUKKAU-UHFFFAOYSA-N
XLogP3.63
TPSA111.63 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500450.52
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-hydroxyphenyl)-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 19460984
N-(furan-2-ylmethyl)-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 19461074
5-(naphthalen-2-yloxymethyl)-N-(pyridin-4-ylmethyl)furan-2-carboxamide
CID 19578864
N-[4-(difluoromethylsulfonyl)phenyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 31523225
N-cycloheptyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 19461005
N-[2-(tert-butylamino)-2-oxoethyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 51213609
N,N-dimethyl-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 39001167
N-[(2-methoxyphenyl)methyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 31491727
N-[(3,4-dimethoxyphenyl)methyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 35523266
N-[(4-hydroxypyrrolidin-3-yl)methyl]-5-(naphthalen-2-yloxymethyl)furan-2-carboxamide
CID 120946987
5-[(4-fluorophenoxy)methyl]-N-[2-(4-methoxyphenyl)ethyl]furan-2-carboxamide
CID 55344956
5-(naphthalen-1-yloxymethyl)-N-(2-phenylethyl)furan-2-carboxamide
CID 35526034

Frequently Asked Questions

What is the IUPAC name of 5-(naphthalen-2-yloxymethyl)-N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide?
The IUPAC name of 5-(naphthalen-2-yloxymethyl)-N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide (CID 55345719) is 5-(naphthalen-2-yloxymethyl)-N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide.
What is the SMILES notation for 5-(naphthalen-2-yloxymethyl)-N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide?
The canonical SMILES for 5-(naphthalen-2-yloxymethyl)-N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide is NS(=O)(=O)c1ccc(CCNC(=O)c2ccc(COc3ccc4ccccc4c3)o2)cc1.
What is the InChIKey of 5-(naphthalen-2-yloxymethyl)-N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide?
The InChIKey is ZAABBJOTWUKKAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N2O5S/c25-32(28,29)22-10-5-17(6-11-22)13-14-26-24(27)23-12-9-21(31-23)16-30-20-8-7-18-3-1-2-4-19(18)15-20/h1-12,15H,13-14,16H2,(H,26,27)(H2,25,28,29).
What are the key properties of 5-(naphthalen-2-yloxymethyl)-N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide?
5-(naphthalen-2-yloxymethyl)-N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide has a molecular weight of 450.52 g/mol, XLogP of 3.63, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(naphthalen-2-yloxymethyl)-N-[2-(4-sulfamoylphenyl)ethyl]furan-2-carboxamide is sourced from PubChem (CID 55345719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).