3-(furan-2-yl)-N-methyl-N-(4-sulfamoylphenyl)propanamide

C14H16N2O4S — CID 61131132

IUPAC3-(furan-2-yl)-N-methyl-N-(4-sulfamoylphenyl)propanamide
SMILESCN(C(=O)CCc1ccco1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C14H16N2O4S/c1-16(14(17)9-6-12-3-2-10-20-12)11-4-7-13(8-5-11)21(15,18)19/h2-5,7-8,10H,6,9H2,1H3,(H2,15,18,19)
InChIKeySVYUYJKPOCPDOK-UHFFFAOYSA-N
MW308.36 g/mol
LogP1.52
Rot. Bonds5

About 3-(furan-2-yl)-N-methyl-N-(4-sulfamoylphenyl)propanamide

3-(furan-2-yl)-N-methyl-N-(4-sulfamoylphenyl)propanamide (PubChem CID 61131132) has the molecular formula C14H16N2O4S and a molecular weight of 308.36 g/mol. Its IUPAC name is 3-(furan-2-yl)-N-methyl-N-(4-sulfamoylphenyl)propanamide.

Molecular Properties

Compound Name3-(furan-2-yl)-N-methyl-N-(4-sulfamoylphenyl)propanamide
PubChem CID61131132
Molecular FormulaC14H16N2O4S
Molecular Weight308.36 g/mol
Exact Mass308.08
IUPAC Name3-(furan-2-yl)-N-methyl-N-(4-sulfamoylphenyl)propanamide
SMILESCN(C(=O)CCc1ccco1)c1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C14H16N2O4S/c1-16(14(17)9-6-12-3-2-10-20-12)11-4-7-13(8-5-11)21(15,18)19/h2-5,7-8,10H,6,9H2,1H3,(H2,15,18,19)
InChIKeySVYUYJKPOCPDOK-UHFFFAOYSA-N
XLogP1.52
TPSA93.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.36
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-[3-(furan-2-yl)propanoyl-methylamino]benzoic acid
CID 104698066
3-(furan-2-yl)-N-[4-(N'-hydroxycarbamimidoyl)phenyl]-N-methylpropanamide
CID 76979523
3-(furan-2-yl)-N-methyl-N-naphthalen-2-ylpropanamide
CID 8851932
3-(furan-2-yl)-N-(4-sulfamoylphenyl)propanamide
CID 18863026
N-(3-carbamothioylphenyl)-3-(furan-2-yl)-N-methylpropanamide
CID 62971167
4-methoxy-N-methyl-N-(4-sulfamoylphenyl)pentanamide
CID 113382234
N-(4-aminophenyl)-2-[furan-2-ylmethyl(methyl)amino]-N-methylacetamide
CID 43526556
N-[(2S)-1-ethylsulfonylpropan-2-yl]-3-(furan-2-yl)-N-methylpropanamide
CID 95625353
2-[3-(furan-2-yl)propanoyl-methylamino]acetic acid
CID 28778124
N-(2-aminopropyl)-3-(furan-2-yl)-N-methylpropanamide
CID 63754121
N-(2-bromoethyl)-3-(furan-2-yl)-N-methylpropanamide
CID 80659443
2-[3-(furan-2-yl)propanoyl-methylamino]-2-methylpropanoic acid
CID 55123873

Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)-N-methyl-N-(4-sulfamoylphenyl)propanamide?
The IUPAC name of 3-(furan-2-yl)-N-methyl-N-(4-sulfamoylphenyl)propanamide (CID 61131132) is 3-(furan-2-yl)-N-methyl-N-(4-sulfamoylphenyl)propanamide.
What is the SMILES notation for 3-(furan-2-yl)-N-methyl-N-(4-sulfamoylphenyl)propanamide?
The canonical SMILES for 3-(furan-2-yl)-N-methyl-N-(4-sulfamoylphenyl)propanamide is CN(C(=O)CCc1ccco1)c1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of 3-(furan-2-yl)-N-methyl-N-(4-sulfamoylphenyl)propanamide?
The InChIKey is SVYUYJKPOCPDOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O4S/c1-16(14(17)9-6-12-3-2-10-20-12)11-4-7-13(8-5-11)21(15,18)19/h2-5,7-8,10H,6,9H2,1H3,(H2,15,18,19).
What are the key properties of 3-(furan-2-yl)-N-methyl-N-(4-sulfamoylphenyl)propanamide?
3-(furan-2-yl)-N-methyl-N-(4-sulfamoylphenyl)propanamide has a molecular weight of 308.36 g/mol, XLogP of 1.52, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)-N-methyl-N-(4-sulfamoylphenyl)propanamide is sourced from PubChem (CID 61131132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).