N-(4-methoxy-3-sulfamoylphenyl)oxolane-2-carboxamide

C12H16N2O5S — CID 43212401

IUPACN-(4-methoxy-3-sulfamoylphenyl)oxolane-2-carboxamide
SMILESCOc1ccc(NC(=O)C2CCCO2)cc1S(N)(=O)=O
InChIInChI=1S/C12H16N2O5S/c1-18-9-5-4-8(7-11(9)20(13,16)17)14-12(15)10-3-2-6-19-10/h4-5,7,10H,2-3,6H2,1H3,(H,14,15)(H2,13,16,17)
InChIKeyPJHNJZCRSBSUDA-UHFFFAOYSA-N
MW300.34 g/mol
LogP0.46
Rot. Bonds4

About N-(4-methoxy-3-sulfamoylphenyl)oxolane-2-carboxamide

N-(4-methoxy-3-sulfamoylphenyl)oxolane-2-carboxamide (PubChem CID 43212401) has the molecular formula C12H16N2O5S and a molecular weight of 300.34 g/mol. Its IUPAC name is N-(4-methoxy-3-sulfamoylphenyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(4-methoxy-3-sulfamoylphenyl)oxolane-2-carboxamide
PubChem CID43212401
Molecular FormulaC12H16N2O5S
Molecular Weight300.34 g/mol
Exact Mass300.08
IUPAC NameN-(4-methoxy-3-sulfamoylphenyl)oxolane-2-carboxamide
SMILESCOc1ccc(NC(=O)C2CCCO2)cc1S(N)(=O)=O
InChIInChI=1S/C12H16N2O5S/c1-18-9-5-4-8(7-11(9)20(13,16)17)14-12(15)10-3-2-6-19-10/h4-5,7,10H,2-3,6H2,1H3,(H,14,15)(H2,13,16,17)
InChIKeyPJHNJZCRSBSUDA-UHFFFAOYSA-N
XLogP0.46
TPSA107.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.34
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)oxolane-2-carboxamide
CID 8800265
N-(3-methyl-4-sulfamoylphenyl)oxolane-2-carboxamide
CID 43133994
N-(3-tert-butyl-4-methoxyphenyl)oxolane-2-carboxamide
CID 110776693
N-(4-methyl-3-sulfamoylphenyl)oxane-2-carboxamide
CID 62213044
N-[(4-methoxy-3-sulfamoylphenyl)methyl]oxolane-2-carboxamide
CID 43246848
N-(3-amino-4-methoxyphenyl)oxane-2-carboxamide
CID 62215161
N-[3-[(4-ethoxyphenyl)sulfamoyl]-4-methoxyphenyl]oxolane-2-carboxamide
CID 43007147
1-cyclobutyl-3-(4-methoxy-3-sulfamoylphenyl)urea
CID 116658847
(2S)-N-(4-methoxy-3-sulfamoylphenyl)-2,3-dihydro-1-benzofuran-2-carboxamide
CID 9088486
ethyl N-[2-methoxy-4-(oxolane-2-carbonylamino)phenyl]carbamate
CID 5305676
methyl 4-[[(2R)-oxolane-2-carbonyl]amino]benzoate
CID 1086797
(2R)-N-[3-[(3,4-dichlorophenyl)sulfonylamino]-4-methoxyphenyl]oxolane-2-carboxamide
CID 26853359

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-3-sulfamoylphenyl)oxolane-2-carboxamide?
The IUPAC name of N-(4-methoxy-3-sulfamoylphenyl)oxolane-2-carboxamide (CID 43212401) is N-(4-methoxy-3-sulfamoylphenyl)oxolane-2-carboxamide.
What is the SMILES notation for N-(4-methoxy-3-sulfamoylphenyl)oxolane-2-carboxamide?
The canonical SMILES for N-(4-methoxy-3-sulfamoylphenyl)oxolane-2-carboxamide is COc1ccc(NC(=O)C2CCCO2)cc1S(N)(=O)=O.
What is the InChIKey of N-(4-methoxy-3-sulfamoylphenyl)oxolane-2-carboxamide?
The InChIKey is PJHNJZCRSBSUDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O5S/c1-18-9-5-4-8(7-11(9)20(13,16)17)14-12(15)10-3-2-6-19-10/h4-5,7,10H,2-3,6H2,1H3,(H,14,15)(H2,13,16,17).
What are the key properties of N-(4-methoxy-3-sulfamoylphenyl)oxolane-2-carboxamide?
N-(4-methoxy-3-sulfamoylphenyl)oxolane-2-carboxamide has a molecular weight of 300.34 g/mol, XLogP of 0.46, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-3-sulfamoylphenyl)oxolane-2-carboxamide is sourced from PubChem (CID 43212401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).