N-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide

C14H14N2O6S — CID 56796448

IUPACN-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide
SMILESCS(=O)(=O)NC(=O)COc1cccc(NC(=O)c2ccco2)c1
InChIInChI=1S/C14H14N2O6S/c1-23(19,20)16-13(17)9-22-11-5-2-4-10(8-11)15-14(18)12-6-3-7-21-12/h2-8H,9H2,1H3,(H,15,18)(H,16,17)
InChIKeyXMHBYJVFTQRGMC-UHFFFAOYSA-N
MW338.34 g/mol
LogP0.99
Rot. Bonds6

About N-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide

N-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide (PubChem CID 56796448) has the molecular formula C14H14N2O6S and a molecular weight of 338.34 g/mol. Its IUPAC name is N-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide
PubChem CID56796448
Molecular FormulaC14H14N2O6S
Molecular Weight338.34 g/mol
Exact Mass338.06
IUPAC NameN-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide
SMILESCS(=O)(=O)NC(=O)COc1cccc(NC(=O)c2ccco2)c1
InChIInChI=1S/C14H14N2O6S/c1-23(19,20)16-13(17)9-22-11-5-2-4-10(8-11)15-14(18)12-6-3-7-21-12/h2-8H,9H2,1H3,(H,15,18)(H,16,17)
InChIKeyXMHBYJVFTQRGMC-UHFFFAOYSA-N
XLogP0.99
TPSA114.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.34
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[3-[2-(2-methoxyethylamino)-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 46547454
N-[3-[2-[(2-amino-2-ethylbutyl)amino]-2-oxoethoxy]phenyl]furan-2-carboxamide;hydrochloride
CID 119642129
N-[3-[2-[[(2S)-1-aminopropan-2-yl]amino]-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 120508274
N-[3-[2-[[(2S)-1-aminopropan-2-yl]amino]-2-oxoethoxy]phenyl]furan-2-carboxamide;hydrochloride
CID 120508273
N-[3-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 46407349
N-[3-[2-[1-(4-methylphenyl)ethylamino]-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 46546691
N-[3-[2-oxo-2-(thiophen-2-ylmethylamino)ethoxy]phenyl]furan-2-carboxamide
CID 55616650
N-[3-[2-[3-(furan-2-ylmethoxymethyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 55933693
N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]furan-2-carboxamide
CID 1491636
N-[3-(3-methylbutoxy)phenyl]furan-2-carboxamide
CID 17097239
N-[3-[2-[(4-aminocyclohexyl)amino]-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 119477145
N-[3-[2-[4-(cyclopentylcarbamoyl)anilino]-2-oxoethoxy]phenyl]furan-2-carboxamide
CID 55959108

Frequently Asked Questions

What is the IUPAC name of N-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide?
The IUPAC name of N-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide (CID 56796448) is N-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide.
What is the SMILES notation for N-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide?
The canonical SMILES for N-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide is CS(=O)(=O)NC(=O)COc1cccc(NC(=O)c2ccco2)c1.
What is the InChIKey of N-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide?
The InChIKey is XMHBYJVFTQRGMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O6S/c1-23(19,20)16-13(17)9-22-11-5-2-4-10(8-11)15-14(18)12-6-3-7-21-12/h2-8H,9H2,1H3,(H,15,18)(H,16,17).
What are the key properties of N-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide?
N-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide has a molecular weight of 338.34 g/mol, XLogP of 0.99, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[2-(methanesulfonamido)-2-oxoethoxy]phenyl]furan-2-carboxamide is sourced from PubChem (CID 56796448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).