5-(cyclopropylsulfamoyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide

C16H18N2O5S — CID 39896410

IUPAC5-(cyclopropylsulfamoyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccc(S(=O)(=O)NC3CC3)o2)cc1
InChIInChI=1S/C16H18N2O5S/c1-22-13-6-2-11(3-7-13)10-17-16(19)14-8-9-15(23-14)24(20,21)18-12-4-5-12/h2-3,6-9,12,18H,4-5,10H2,1H3,(H,17,19)
InChIKeyXZXPJQLCWHYOOA-UHFFFAOYSA-N
MW350.40 g/mol
LogP1.66
Rot. Bonds7

About 5-(cyclopropylsulfamoyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide

5-(cyclopropylsulfamoyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide (PubChem CID 39896410) has the molecular formula C16H18N2O5S and a molecular weight of 350.40 g/mol. Its IUPAC name is 5-(cyclopropylsulfamoyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-(cyclopropylsulfamoyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide
PubChem CID39896410
Molecular FormulaC16H18N2O5S
Molecular Weight350.40 g/mol
Exact Mass350.09
IUPAC Name5-(cyclopropylsulfamoyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide
SMILESCOc1ccc(CNC(=O)c2ccc(S(=O)(=O)NC3CC3)o2)cc1
InChIInChI=1S/C16H18N2O5S/c1-22-13-6-2-11(3-7-13)10-17-16(19)14-8-9-15(23-14)24(20,21)18-12-4-5-12/h2-3,6-9,12,18H,4-5,10H2,1H3,(H,17,19)
InChIKeyXZXPJQLCWHYOOA-UHFFFAOYSA-N
XLogP1.66
TPSA97.64 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.40
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-(cyclopropylsulfamoyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide?
The IUPAC name of 5-(cyclopropylsulfamoyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide (CID 39896410) is 5-(cyclopropylsulfamoyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide.
What is the SMILES notation for 5-(cyclopropylsulfamoyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide?
The canonical SMILES for 5-(cyclopropylsulfamoyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide is COc1ccc(CNC(=O)c2ccc(S(=O)(=O)NC3CC3)o2)cc1.
What is the InChIKey of 5-(cyclopropylsulfamoyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide?
The InChIKey is XZXPJQLCWHYOOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O5S/c1-22-13-6-2-11(3-7-13)10-17-16(19)14-8-9-15(23-14)24(20,21)18-12-4-5-12/h2-3,6-9,12,18H,4-5,10H2,1H3,(H,17,19).
What are the key properties of 5-(cyclopropylsulfamoyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide?
5-(cyclopropylsulfamoyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide has a molecular weight of 350.40 g/mol, XLogP of 1.66, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(cyclopropylsulfamoyl)-N-[(4-methoxyphenyl)methyl]furan-2-carboxamide is sourced from PubChem (CID 39896410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).