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

C17H17FN2O4S — CID 95233016

IUPAC(2S)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]oxolane-2-carboxamide
SMILESO=C(Nc1ccccc1NS(=O)(=O)c1ccc(F)cc1)[C@@H]1CCCO1
InChIInChI=1S/C17H17FN2O4S/c18-12-7-9-13(10-8-12)25(22,23)20-15-5-2-1-4-14(15)19-17(21)16-6-3-11-24-16/h1-2,4-5,7-10,16,20H,3,6,11H2,(H,19,21)/t16-/m0/s1
InChIKeyHYLDEEBLIIXSGQ-INIZCTEOSA-N
MW364.40 g/mol
LogP2.74
Rot. Bonds5

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

(2S)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]oxolane-2-carboxamide (PubChem CID 95233016) has the molecular formula C17H17FN2O4S and a molecular weight of 364.40 g/mol. Its IUPAC name is (2S)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]oxolane-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]oxolane-2-carboxamide
PubChem CID95233016
Molecular FormulaC17H17FN2O4S
Molecular Weight364.40 g/mol
Exact Mass364.09
IUPAC Name(2S)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]oxolane-2-carboxamide
SMILESO=C(Nc1ccccc1NS(=O)(=O)c1ccc(F)cc1)[C@@H]1CCCO1
InChIInChI=1S/C17H17FN2O4S/c18-12-7-9-13(10-8-12)25(22,23)20-15-5-2-1-4-14(15)19-17(21)16-6-3-11-24-16/h1-2,4-5,7-10,16,20H,3,6,11H2,(H,19,21)/t16-/m0/s1
InChIKeyHYLDEEBLIIXSGQ-INIZCTEOSA-N
XLogP2.74
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.40
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-fluoro-N-[2-[4-(oxolane-2-carbonyl)piperazine-1-carbonyl]phenyl]benzenesulfonamide
CID 55371330
N-[5-fluoro-2-(methanesulfonamido)phenyl]oxolane-2-carboxamide
CID 113093316
N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]piperidine-4-carboxamide;hydrochloride
CID 119264337
3-amino-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]cyclopentane-1-carboxamide
CID 119676621
N-[2-[(2-aminoacetyl)amino]phenyl]oxolane-2-carboxamide
CID 82034964
5-chloro-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]-2,3-dihydro-1-benzofuran-2-carboxamide
CID 166206767
N-(2-phenylphenyl)oxolane-2-carboxamide
CID 2995133
N-[4-(benzoylsulfamoyl)phenyl]oxolane-2-carboxamide
CID 2970623
N-(2-nitrophenyl)oxolane-2-carboxamide
CID 5093204
N-(2-cyanophenyl)oxolane-2-carboxamide
CID 2948515
2-[2-[[(2S)-oxolane-2-carbonyl]amino]phenyl]acetic acid
CID 104855642
2-fluoro-6-[[(2S)-oxolane-2-carbonyl]amino]benzoic acid
CID 113462407

Frequently Asked Questions

What is the IUPAC name of (2S)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]oxolane-2-carboxamide?
The IUPAC name of (2S)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]oxolane-2-carboxamide (CID 95233016) is (2S)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]oxolane-2-carboxamide.
What is the SMILES notation for (2S)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]oxolane-2-carboxamide?
The canonical SMILES for (2S)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]oxolane-2-carboxamide is O=C(Nc1ccccc1NS(=O)(=O)c1ccc(F)cc1)[C@@H]1CCCO1.
What is the InChIKey of (2S)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]oxolane-2-carboxamide?
The InChIKey is HYLDEEBLIIXSGQ-INIZCTEOSA-N. The full InChI is InChI=1S/C17H17FN2O4S/c18-12-7-9-13(10-8-12)25(22,23)20-15-5-2-1-4-14(15)19-17(21)16-6-3-11-24-16/h1-2,4-5,7-10,16,20H,3,6,11H2,(H,19,21)/t16-/m0/s1.
What are the key properties of (2S)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]oxolane-2-carboxamide?
(2S)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]oxolane-2-carboxamide has a molecular weight of 364.40 g/mol, XLogP of 2.74, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]oxolane-2-carboxamide is sourced from PubChem (CID 95233016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).