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

C20H26N2O4S — CID 9294142

IUPAC4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]-N-(4-propylphenyl)benzamide
SMILESCCCc1ccc(NC(=O)c2ccc(S(=O)(=O)N[C@H](C)COC)cc2)cc1
InChIInChI=1S/C20H26N2O4S/c1-4-5-16-6-10-18(11-7-16)21-20(23)17-8-12-19(13-9-17)27(24,25)22-15(2)14-26-3/h6-13,15,22H,4-5,14H2,1-3H3,(H,21,23)/t15-/m1/s1
InChIKeyFTYWXIDFFJGTSR-OAHLLOKOSA-N
MW390.51 g/mol
LogP3.20
Rot. Bonds9

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

4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]-N-(4-propylphenyl)benzamide (PubChem CID 9294142) has the molecular formula C20H26N2O4S and a molecular weight of 390.51 g/mol. Its IUPAC name is 4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]-N-(4-propylphenyl)benzamide.

Molecular Properties

Compound Name4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]-N-(4-propylphenyl)benzamide
PubChem CID9294142
Molecular FormulaC20H26N2O4S
Molecular Weight390.51 g/mol
Exact Mass390.16
IUPAC Name4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]-N-(4-propylphenyl)benzamide
SMILESCCCc1ccc(NC(=O)c2ccc(S(=O)(=O)N[C@H](C)COC)cc2)cc1
InChIInChI=1S/C20H26N2O4S/c1-4-5-16-6-10-18(11-7-16)21-20(23)17-8-12-19(13-9-17)27(24,25)22-15(2)14-26-3/h6-13,15,22H,4-5,14H2,1-3H3,(H,21,23)/t15-/m1/s1
InChIKeyFTYWXIDFFJGTSR-OAHLLOKOSA-N
XLogP3.20
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 ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]-N-(4-propylphenyl)benzamide?
The IUPAC name of 4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]-N-(4-propylphenyl)benzamide (CID 9294142) is 4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]-N-(4-propylphenyl)benzamide.
What is the SMILES notation for 4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]-N-(4-propylphenyl)benzamide?
The canonical SMILES for 4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]-N-(4-propylphenyl)benzamide is CCCc1ccc(NC(=O)c2ccc(S(=O)(=O)N[C@H](C)COC)cc2)cc1.
What is the InChIKey of 4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]-N-(4-propylphenyl)benzamide?
The InChIKey is FTYWXIDFFJGTSR-OAHLLOKOSA-N. The full InChI is InChI=1S/C20H26N2O4S/c1-4-5-16-6-10-18(11-7-16)21-20(23)17-8-12-19(13-9-17)27(24,25)22-15(2)14-26-3/h6-13,15,22H,4-5,14H2,1-3H3,(H,21,23)/t15-/m1/s1.
What are the key properties of 4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]-N-(4-propylphenyl)benzamide?
4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]-N-(4-propylphenyl)benzamide has a molecular weight of 390.51 g/mol, XLogP of 3.20, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[(2R)-1-methoxypropan-2-yl]sulfamoyl]-N-(4-propylphenyl)benzamide is sourced from PubChem (CID 9294142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).