N-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]oxolane-2-carboxamide

C18H21NO6S — CID 110315105

IUPACN-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]oxolane-2-carboxamide
SMILESCOc1ccc(S(=O)(=O)C(CNC(=O)C2CCCO2)c2ccco2)cc1
InChIInChI=1S/C18H21NO6S/c1-23-13-6-8-14(9-7-13)26(21,22)17(15-4-2-10-24-15)12-19-18(20)16-5-3-11-25-16/h2,4,6-10,16-17H,3,5,11-12H2,1H3,(H,19,20)
InChIKeyTUYBKCSKYPUYEH-UHFFFAOYSA-N
MW379.43 g/mol
LogP2.10
Rot. Bonds7

About N-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]oxolane-2-carboxamide

N-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]oxolane-2-carboxamide (PubChem CID 110315105) has the molecular formula C18H21NO6S and a molecular weight of 379.43 g/mol. Its IUPAC name is N-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]oxolane-2-carboxamide
PubChem CID110315105
Molecular FormulaC18H21NO6S
Molecular Weight379.43 g/mol
Exact Mass379.11
IUPAC NameN-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]oxolane-2-carboxamide
SMILESCOc1ccc(S(=O)(=O)C(CNC(=O)C2CCCO2)c2ccco2)cc1
InChIInChI=1S/C18H21NO6S/c1-23-13-6-8-14(9-7-13)26(21,22)17(15-4-2-10-24-15)12-19-18(20)16-5-3-11-25-16/h2,4,6-10,16-17H,3,5,11-12H2,1H3,(H,19,20)
InChIKeyTUYBKCSKYPUYEH-UHFFFAOYSA-N
XLogP2.10
TPSA94.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.43
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(4-methoxyphenyl)sulfonyl-2-phenylethyl]oxolane-2-carboxamide
CID 110315083
N-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]cyclopropanecarboxamide
CID 110315102
N-[(2R)-2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]adamantane-1-carboxamide
CID 26792762
N-[2-(furan-2-yl)-2-hydroxyethyl]oxolane-2-carboxamide
CID 110889373
2,6-difluoro-N-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]benzamide
CID 20962895
5-bromo-N-[(2S)-2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]furan-2-carboxamide
CID 26792715
N-[(2R)-2-(benzenesulfonyl)-2-(furan-2-yl)ethyl]cyclohexanecarboxamide
CID 7267957
N-[(2S)-2-(furan-2-yl)-2-(4-methylphenyl)sulfonylethyl]-3-methoxybenzamide
CID 7268107
2-[2-(dimethylsulfamoylamino)-1-(4-methoxyphenyl)sulfonylethyl]furan
CID 110315122
N'-[(2S)-2-(benzenesulfonyl)-2-(furan-2-yl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]oxamide
CID 40775081
N'-[(2R)-2-(4-fluorophenyl)sulfonyl-2-(furan-2-yl)ethyl]-N-[2-(4-methoxyphenyl)ethyl]oxamide
CID 40774997
N-[2-(4-methoxyphenyl)-2-methylpropyl]oxolane-2-carboxamide
CID 47472788

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]oxolane-2-carboxamide?
The IUPAC name of N-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]oxolane-2-carboxamide (CID 110315105) is N-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]oxolane-2-carboxamide?
The canonical SMILES for N-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]oxolane-2-carboxamide is COc1ccc(S(=O)(=O)C(CNC(=O)C2CCCO2)c2ccco2)cc1.
What is the InChIKey of N-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]oxolane-2-carboxamide?
The InChIKey is TUYBKCSKYPUYEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO6S/c1-23-13-6-8-14(9-7-13)26(21,22)17(15-4-2-10-24-15)12-19-18(20)16-5-3-11-25-16/h2,4,6-10,16-17H,3,5,11-12H2,1H3,(H,19,20).
What are the key properties of N-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]oxolane-2-carboxamide?
N-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]oxolane-2-carboxamide has a molecular weight of 379.43 g/mol, XLogP of 2.10, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-yl)-2-(4-methoxyphenyl)sulfonylethyl]oxolane-2-carboxamide is sourced from PubChem (CID 110315105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).