4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide

C20H26N2O4S — CID 9301798

IUPAC4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide
SMILESCOC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NC[C@H](C)c2ccccc2)cc1
InChIInChI=1S/C20H26N2O4S/c1-15(17-7-5-4-6-8-17)13-21-20(23)18-9-11-19(12-10-18)27(24,25)22-16(2)14-26-3/h4-12,15-16,22H,13-14H2,1-3H3,(H,21,23)/t15-,16-/m0/s1
InChIKeyDPXRAIIMOYZVSU-HOTGVXAUSA-N
MW390.51 g/mol
LogP2.53
Rot. Bonds9

About 4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide

4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide (PubChem CID 9301798) has the molecular formula C20H26N2O4S and a molecular weight of 390.51 g/mol. Its IUPAC name is 4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide.

Molecular Properties

Compound Name4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide
PubChem CID9301798
Molecular FormulaC20H26N2O4S
Molecular Weight390.51 g/mol
Exact Mass390.16
IUPAC Name4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide
SMILESCOC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NC[C@H](C)c2ccccc2)cc1
InChIInChI=1S/C20H26N2O4S/c1-15(17-7-5-4-6-8-17)13-21-20(23)18-9-11-19(12-10-18)27(24,25)22-16(2)14-26-3/h4-12,15-16,22H,13-14H2,1-3H3,(H,21,23)/t15-,16-/m0/s1
InChIKeyDPXRAIIMOYZVSU-HOTGVXAUSA-N
XLogP2.53
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.51
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(ethylamino)-2-oxoethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide
CID 9224721
N-[2-oxo-2-[[(2R)-2-phenylpropyl]amino]ethyl]-4-(propan-2-ylsulfamoyl)benzamide
CID 9427293
N-[4-(1-methoxypropan-2-ylsulfamoyl)phenyl]-3-phenylbutanamide
CID 43007936
4-(dimethylsulfamoyl)-N-[(2R)-2-phenylpropyl]benzamide
CID 9301395
4-[(4-methylphenyl)sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide
CID 9164353
4-[(2-methylphenyl)sulfamoyl]-N-[(2S)-2-phenylpropyl]benzamide
CID 9164348
4-[(4-fluorophenyl)sulfonylamino]-N-[(2R)-2-phenylpropyl]benzamide
CID 9164346
N-[(2S)-1-methoxypropan-2-yl]-4-[(pyridine-2-carbonylamino)carbamoyl]benzenesulfonamide
CID 9331832
4-methyl-N-[(2R)-2-phenylpropyl]benzamide
CID 9302175
N-[(1R)-1-(4-chlorophenyl)ethyl]-4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]benzamide
CID 9218502
N-[(1S)-1-(4-chlorophenyl)ethyl]-4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]benzamide
CID 9218496
N-[(1S)-1-(1-benzofuran-2-yl)ethyl]-4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]benzamide
CID 9367554

Frequently Asked Questions

What is the IUPAC name of 4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide?
The IUPAC name of 4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide (CID 9301798) is 4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide.
What is the SMILES notation for 4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide?
The canonical SMILES for 4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide is COC[C@H](C)NS(=O)(=O)c1ccc(C(=O)NC[C@H](C)c2ccccc2)cc1.
What is the InChIKey of 4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide?
The InChIKey is DPXRAIIMOYZVSU-HOTGVXAUSA-N. The full InChI is InChI=1S/C20H26N2O4S/c1-15(17-7-5-4-6-8-17)13-21-20(23)18-9-11-19(12-10-18)27(24,25)22-16(2)14-26-3/h4-12,15-16,22H,13-14H2,1-3H3,(H,21,23)/t15-,16-/m0/s1.
What are the key properties of 4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide?
4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide has a molecular weight of 390.51 g/mol, XLogP of 2.53, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(2S)-1-methoxypropan-2-yl]sulfamoyl]-N-[(2R)-2-phenylpropyl]benzamide is sourced from PubChem (CID 9301798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).