N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide

C24H27N3O6S — CID 30671122

IUPACN-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide
SMILESCOc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)Cc1ccc(OCc2c(C)noc2C)cc1
InChIInChI=1S/C24H27N3O6S/c1-15-21(16(2)33-26-15)14-32-19-8-4-17(5-9-19)12-24(28)25-22-13-20(10-11-23(22)31-3)34(29,30)27-18-6-7-18/h4-5,8-11,13,18,27H,6-7,12,14H2,1-3H3,(H,25,28)
InChIKeyQCBVJAMUTJCYPO-UHFFFAOYSA-N
MW485.56 g/mol
LogP3.50
Rot. Bonds10

About N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide

N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide (PubChem CID 30671122) has the molecular formula C24H27N3O6S and a molecular weight of 485.56 g/mol. Its IUPAC name is N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide.

Molecular Properties

Compound NameN-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide
PubChem CID30671122
Molecular FormulaC24H27N3O6S
Molecular Weight485.56 g/mol
Exact Mass485.16
IUPAC NameN-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide
SMILESCOc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)Cc1ccc(OCc2c(C)noc2C)cc1
InChIInChI=1S/C24H27N3O6S/c1-15-21(16(2)33-26-15)14-32-19-8-4-17(5-9-19)12-24(28)25-22-13-20(10-11-23(22)31-3)34(29,30)27-18-6-7-18/h4-5,8-11,13,18,27H,6-7,12,14H2,1-3H3,(H,25,28)
InChIKeyQCBVJAMUTJCYPO-UHFFFAOYSA-N
XLogP3.50
TPSA119.76 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds10
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500485.56
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-(methylamino)acetamide
CID 119701916
N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-thiophen-2-ylacetamide
CID 33159236
N-cyclopentyl-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide
CID 9265218
N-(2,5-dimethoxyphenyl)-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 30273731
N-(3,5-dimethoxyphenyl)-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide
CID 7960814
2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-(2,5-dimethylphenyl)acetamide
CID 26500066
3-amino-N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]propanamide
CID 119277783
N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-(2,6-dimethylphenoxy)acetamide
CID 46535363
3-(4-chlorophenyl)-N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]propanamide
CID 33161073
[1-(2-methoxy-5-methylanilino)-1-oxopropan-2-yl] 2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetate
CID 46647063
2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-(3,5-dimethylphenyl)acetamide
CID 7961030
N-(2,4-dichlorophenyl)-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide
CID 26115421

Frequently Asked Questions

What is the IUPAC name of N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide?
The IUPAC name of N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide (CID 30671122) is N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide.
What is the SMILES notation for N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide?
The canonical SMILES for N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide is COc1ccc(S(=O)(=O)NC2CC2)cc1NC(=O)Cc1ccc(OCc2c(C)noc2C)cc1.
What is the InChIKey of N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide?
The InChIKey is QCBVJAMUTJCYPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O6S/c1-15-21(16(2)33-26-15)14-32-19-8-4-17(5-9-19)12-24(28)25-22-13-20(10-11-23(22)31-3)34(29,30)27-18-6-7-18/h4-5,8-11,13,18,27H,6-7,12,14H2,1-3H3,(H,25,28).
What are the key properties of N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide?
N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide has a molecular weight of 485.56 g/mol, XLogP of 3.50, 10 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(cyclopropylsulfamoyl)-2-methoxyphenyl]-2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]acetamide is sourced from PubChem (CID 30671122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).