(2S)-N-[4-(diethylsulfamoyl)phenyl]oxolane-2-carboxamide

C15H22N2O4S — CID 900571

IUPAC(2S)-N-[4-(diethylsulfamoyl)phenyl]oxolane-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)[C@@H]2CCCO2)cc1
InChIInChI=1S/C15H22N2O4S/c1-3-17(4-2)22(19,20)13-9-7-12(8-10-13)16-15(18)14-6-5-11-21-14/h7-10,14H,3-6,11H2,1-2H3,(H,16,18)/t14-/m0/s1
InChIKeyQNQWJPKMSWKPGP-AWEZNQCLSA-N
MW326.42 g/mol
LogP1.83
Rot. Bonds6

About (2S)-N-[4-(diethylsulfamoyl)phenyl]oxolane-2-carboxamide

(2S)-N-[4-(diethylsulfamoyl)phenyl]oxolane-2-carboxamide (PubChem CID 900571) has the molecular formula C15H22N2O4S and a molecular weight of 326.42 g/mol. Its IUPAC name is (2S)-N-[4-(diethylsulfamoyl)phenyl]oxolane-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-[4-(diethylsulfamoyl)phenyl]oxolane-2-carboxamide
PubChem CID900571
Molecular FormulaC15H22N2O4S
Molecular Weight326.42 g/mol
Exact Mass326.13
IUPAC Name(2S)-N-[4-(diethylsulfamoyl)phenyl]oxolane-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc(NC(=O)[C@@H]2CCCO2)cc1
InChIInChI=1S/C15H22N2O4S/c1-3-17(4-2)22(19,20)13-9-7-12(8-10-13)16-15(18)14-6-5-11-21-14/h7-10,14H,3-6,11H2,1-2H3,(H,16,18)/t14-/m0/s1
InChIKeyQNQWJPKMSWKPGP-AWEZNQCLSA-N
XLogP1.83
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.42
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2S)-N-[4-(diethylsulfamoyl)phenyl]oxolane-2-carboxamide?
The IUPAC name of (2S)-N-[4-(diethylsulfamoyl)phenyl]oxolane-2-carboxamide (CID 900571) is (2S)-N-[4-(diethylsulfamoyl)phenyl]oxolane-2-carboxamide.
What is the SMILES notation for (2S)-N-[4-(diethylsulfamoyl)phenyl]oxolane-2-carboxamide?
The canonical SMILES for (2S)-N-[4-(diethylsulfamoyl)phenyl]oxolane-2-carboxamide is CCN(CC)S(=O)(=O)c1ccc(NC(=O)[C@@H]2CCCO2)cc1.
What is the InChIKey of (2S)-N-[4-(diethylsulfamoyl)phenyl]oxolane-2-carboxamide?
The InChIKey is QNQWJPKMSWKPGP-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H22N2O4S/c1-3-17(4-2)22(19,20)13-9-7-12(8-10-13)16-15(18)14-6-5-11-21-14/h7-10,14H,3-6,11H2,1-2H3,(H,16,18)/t14-/m0/s1.
What are the key properties of (2S)-N-[4-(diethylsulfamoyl)phenyl]oxolane-2-carboxamide?
(2S)-N-[4-(diethylsulfamoyl)phenyl]oxolane-2-carboxamide has a molecular weight of 326.42 g/mol, XLogP of 1.83, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[4-(diethylsulfamoyl)phenyl]oxolane-2-carboxamide is sourced from PubChem (CID 900571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).