N-[2,5-dimethoxy-4-[(4-methoxyphenyl)sulfonylamino]phenyl]furan-2-carboxamide

C20H20N2O7S — CID 648355

IUPACN-[2,5-dimethoxy-4-[(4-methoxyphenyl)sulfonylamino]phenyl]furan-2-carboxamide
SMILESCOc1ccc(S(=O)(=O)Nc2cc(OC)c(NC(=O)c3ccco3)cc2OC)cc1
InChIInChI=1S/C20H20N2O7S/c1-26-13-6-8-14(9-7-13)30(24,25)22-16-12-18(27-2)15(11-19(16)28-3)21-20(23)17-5-4-10-29-17/h4-12,22H,1-3H3,(H,21,23)
InChIKeyRYHSAXRBHDHPPK-UHFFFAOYSA-N
MW432.45 g/mol
LogP3.36
Rot. Bonds8

About N-[2,5-dimethoxy-4-[(4-methoxyphenyl)sulfonylamino]phenyl]furan-2-carboxamide

N-[2,5-dimethoxy-4-[(4-methoxyphenyl)sulfonylamino]phenyl]furan-2-carboxamide (PubChem CID 648355) has the molecular formula C20H20N2O7S and a molecular weight of 432.45 g/mol. Its IUPAC name is N-[2,5-dimethoxy-4-[(4-methoxyphenyl)sulfonylamino]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[2,5-dimethoxy-4-[(4-methoxyphenyl)sulfonylamino]phenyl]furan-2-carboxamide
PubChem CID648355
Molecular FormulaC20H20N2O7S
Molecular Weight432.45 g/mol
Exact Mass432.10
IUPAC NameN-[2,5-dimethoxy-4-[(4-methoxyphenyl)sulfonylamino]phenyl]furan-2-carboxamide
SMILESCOc1ccc(S(=O)(=O)Nc2cc(OC)c(NC(=O)c3ccco3)cc2OC)cc1
InChIInChI=1S/C20H20N2O7S/c1-26-13-6-8-14(9-7-13)30(24,25)22-16-12-18(27-2)15(11-19(16)28-3)21-20(23)17-5-4-10-29-17/h4-12,22H,1-3H3,(H,21,23)
InChIKeyRYHSAXRBHDHPPK-UHFFFAOYSA-N
XLogP3.36
TPSA116.10 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.45
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-[3-[(2-fluorophenyl)sulfamoyl]phenyl]furan-2-carboxamide
CID 4597423
Cambridge id 5798025
CID 744285
N-{2-[(2,5-dimethoxyphenyl)amino]-2-oxoethyl}furan-2-carboxamide
CID 1243336
N-[3-(2,5-dimethoxyanilino)-3-oxopropyl]furan-2-carboxamide
CID 9502225
N-{4-[(2,6-dimethylmorpholin-4-yl)sulfonyl]phenyl}furan-2-carboxamide
CID 649025
N-[4-(1,1,3,3-tetraoxo-1lambda6,3lambda6,2-benzodithiazol-2-yl)phenyl]furan-2-carboxamide
CID 4066845
N-(2,5-Dimethoxyphenyl)-2-furancarboxamide
CID 531896
N-{4-[(Furan-2-carbonyl)-amino]-2,5-dimethoxy-phenyl}-N'-o-tolyl-succinamide
CID 644690
Furan-2-carboxylic acid [4-(4-chloro-benzenesulfonylamino)-2,5-dimethoxy-phenyl]-amide
CID 644978
Furan-2-carboxylic acid [2,5-diethoxy-4-(2-o-tolyloxy-acetylamino)-phenyl]-amide
CID 647825
N-[2,5-dimethoxy-4-[[oxo(thiophen-2-yl)methyl]amino]phenyl]-2-furancarboxamide
CID 648371
N-[2-methoxy-4-[(2-methyl-1-oxopropyl)amino]phenyl]-2-furancarboxamide
CID 650589

Frequently Asked Questions

What is the IUPAC name of N-[2,5-dimethoxy-4-[(4-methoxyphenyl)sulfonylamino]phenyl]furan-2-carboxamide?
The IUPAC name of N-[2,5-dimethoxy-4-[(4-methoxyphenyl)sulfonylamino]phenyl]furan-2-carboxamide (CID 648355) is N-[2,5-dimethoxy-4-[(4-methoxyphenyl)sulfonylamino]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[2,5-dimethoxy-4-[(4-methoxyphenyl)sulfonylamino]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[2,5-dimethoxy-4-[(4-methoxyphenyl)sulfonylamino]phenyl]furan-2-carboxamide is COc1ccc(S(=O)(=O)Nc2cc(OC)c(NC(=O)c3ccco3)cc2OC)cc1.
What is the InChIKey of N-[2,5-dimethoxy-4-[(4-methoxyphenyl)sulfonylamino]phenyl]furan-2-carboxamide?
The InChIKey is RYHSAXRBHDHPPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O7S/c1-26-13-6-8-14(9-7-13)30(24,25)22-16-12-18(27-2)15(11-19(16)28-3)21-20(23)17-5-4-10-29-17/h4-12,22H,1-3H3,(H,21,23).
What are the key properties of N-[2,5-dimethoxy-4-[(4-methoxyphenyl)sulfonylamino]phenyl]furan-2-carboxamide?
N-[2,5-dimethoxy-4-[(4-methoxyphenyl)sulfonylamino]phenyl]furan-2-carboxamide has a molecular weight of 432.45 g/mol, XLogP of 3.36, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,5-dimethoxy-4-[(4-methoxyphenyl)sulfonylamino]phenyl]furan-2-carboxamide is sourced from PubChem (CID 648355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).