N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide

C14H15N3O5S — CID 9141000

IUPACN-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide
SMILESCc1ccc(NC(=O)CNC(=O)c2ccco2)cc1S(N)(=O)=O
InChIInChI=1S/C14H15N3O5S/c1-9-4-5-10(7-12(9)23(15,20)21)17-13(18)8-16-14(19)11-3-2-6-22-11/h2-7H,8H2,1H3,(H,16,19)(H,17,18)(H2,15,20,21)
InChIKeyWLXZZRWRBULWJD-UHFFFAOYSA-N
MW337.36 g/mol
LogP0.60
Rot. Bonds5

About N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide

N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide (PubChem CID 9141000) has the molecular formula C14H15N3O5S and a molecular weight of 337.36 g/mol. Its IUPAC name is N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide
PubChem CID9141000
Molecular FormulaC14H15N3O5S
Molecular Weight337.36 g/mol
Exact Mass337.07
IUPAC NameN-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide
SMILESCc1ccc(NC(=O)CNC(=O)c2ccco2)cc1S(N)(=O)=O
InChIInChI=1S/C14H15N3O5S/c1-9-4-5-10(7-12(9)23(15,20)21)17-13(18)8-16-14(19)11-3-2-6-22-11/h2-7H,8H2,1H3,(H,16,19)(H,17,18)(H2,15,20,21)
InChIKeyWLXZZRWRBULWJD-UHFFFAOYSA-N
XLogP0.60
TPSA131.50 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.36
LogP ≤ 50.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[3-[(4-chlorophenyl)sulfamoyl]-4-methylanilino]-2-oxoethyl]furan-2-carboxamide
CID 30474795
[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl] 2-(furan-2-carbonylamino)-3-methylbutanoate
CID 55366879
N-[4-[3-[(4-chlorophenyl)sulfamoyl]-4-methylanilino]-4-oxobutyl]furan-2-carboxamide
CID 39761071
N-[2-(3-methylsulfanylanilino)-2-oxoethyl]furan-2-carboxamide
CID 9402829
N-[2-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-2-oxoethyl]furan-2-carboxamide
CID 6461351
N-[2-oxo-2-[[2-oxo-2-(4-propylanilino)ethyl]amino]ethyl]furan-2-carboxamide
CID 9225396
N-[2-[[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]amino]-2-oxoethyl]furan-2-carboxamide
CID 9269646
N-[2-[2-methyl-5-(thiophene-2-carbonylamino)anilino]-2-oxoethyl]furan-2-carboxamide
CID 23856004
N-[2-[(3,4-dimethylphenyl)carbamoylamino]ethyl]furan-2-carboxamide
CID 47031833
N-(4-methyl-3-sulfamoylphenyl)-2-(prop-2-enylamino)acetamide
CID 78912240
N-[2-[(2-methyl-5-sulfamoylbenzoyl)amino]ethyl]furan-2-carboxamide
CID 30797230
N-[4-[3-[(2-methoxyphenyl)sulfamoyl]-4-methylanilino]-4-oxobutyl]furan-2-carboxamide
CID 39754906

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide?
The IUPAC name of N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide (CID 9141000) is N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide.
What is the SMILES notation for N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide?
The canonical SMILES for N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide is Cc1ccc(NC(=O)CNC(=O)c2ccco2)cc1S(N)(=O)=O.
What is the InChIKey of N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide?
The InChIKey is WLXZZRWRBULWJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O5S/c1-9-4-5-10(7-12(9)23(15,20)21)17-13(18)8-16-14(19)11-3-2-6-22-11/h2-7H,8H2,1H3,(H,16,19)(H,17,18)(H2,15,20,21).
What are the key properties of N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide?
N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide has a molecular weight of 337.36 g/mol, XLogP of 0.60, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methyl-3-sulfamoylanilino)-2-oxoethyl]furan-2-carboxamide is sourced from PubChem (CID 9141000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).