N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide

C23H31N3O6S — CID 32707883

IUPACN-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide
SMILESCc1ccc([C@@H](CNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)N2CCOCC2)o1
InChIInChI=1S/C23H31N3O6S/c1-17-4-9-22(32-17)21(26-10-13-30-14-11-26)16-24-23(27)18-5-7-20(8-6-18)33(28,29)25-15-19-3-2-12-31-19/h4-9,19,21,25H,2-3,10-16H2,1H3,(H,24,27)/t19-,21-/m1/s1
InChIKeyCLCYGGUXVULAGY-TZIWHRDSSA-N
MW477.58 g/mol
LogP1.85
Rot. Bonds9

About N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide

N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide (PubChem CID 32707883) has the molecular formula C23H31N3O6S and a molecular weight of 477.58 g/mol. Its IUPAC name is N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide.

Molecular Properties

Compound NameN-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide
PubChem CID32707883
Molecular FormulaC23H31N3O6S
Molecular Weight477.58 g/mol
Exact Mass477.19
IUPAC NameN-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide
SMILESCc1ccc([C@@H](CNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)N2CCOCC2)o1
InChIInChI=1S/C23H31N3O6S/c1-17-4-9-22(32-17)21(26-10-13-30-14-11-26)16-24-23(27)18-5-7-20(8-6-18)33(28,29)25-15-19-3-2-12-31-19/h4-9,19,21,25H,2-3,10-16H2,1H3,(H,24,27)/t19-,21-/m1/s1
InChIKeyCLCYGGUXVULAGY-TZIWHRDSSA-N
XLogP1.85
TPSA110.11 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500477.58
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide with MolForge

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Related Compounds

4-(methoxysulfamoyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide
CID 55821677
N-[2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 24544259
3-[(4-acetylphenyl)sulfonylamino]-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]propanamide
CID 55519754
N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-3-(oxolan-2-ylmethoxy)propanamide
CID 55713256
(2S)-N-[(2S)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]oxolane-2-carboxamide
CID 94180518
4-[(2,5-dimethylphenyl)sulfonylamino]-N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]benzamide
CID 31444791
N-(2,6-dimethylphenyl)-4-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 109060029
N-(2-acetamidoethyl)-4-[[(2S)-oxolan-2-yl]methylsulfamoyl]benzamide
CID 41129794
N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-(2-phenylethynyl)benzamide
CID 24643832
N-(4-morpholin-4-ylphenyl)-4-[[(2S)-oxolan-2-yl]methylsulfamoyl]benzamide
CID 41094823
N-[(1,5-dimethylpyrrol-2-yl)methyl]-4-(oxolan-2-ylmethylsulfamoyl)benzamide
CID 43003903
4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzoic acid
CID 796841

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide?
The IUPAC name of N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide (CID 32707883) is N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide.
What is the SMILES notation for N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide?
The canonical SMILES for N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide is Cc1ccc([C@@H](CNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)N2CCOCC2)o1.
What is the InChIKey of N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide?
The InChIKey is CLCYGGUXVULAGY-TZIWHRDSSA-N. The full InChI is InChI=1S/C23H31N3O6S/c1-17-4-9-22(32-17)21(26-10-13-30-14-11-26)16-24-23(27)18-5-7-20(8-6-18)33(28,29)25-15-19-3-2-12-31-19/h4-9,19,21,25H,2-3,10-16H2,1H3,(H,24,27)/t19-,21-/m1/s1.
What are the key properties of N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide?
N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide has a molecular weight of 477.58 g/mol, XLogP of 1.85, 9 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-4-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide is sourced from PubChem (CID 32707883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).