N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2-(4-methoxyphenoxy)propanamide

C23H30N2O5S — CID 108736372

IUPACN-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2-(4-methoxyphenoxy)propanamide
SMILESCOc1ccc(OC(C)C(=O)NCCc2ccc(S(=O)(=O)NC3CCCC3)cc2)cc1
InChIInChI=1S/C23H30N2O5S/c1-17(30-21-11-9-20(29-2)10-12-21)23(26)24-16-15-18-7-13-22(14-8-18)31(27,28)25-19-5-3-4-6-19/h7-14,17,19,25H,3-6,15-16H2,1-2H3,(H,24,26)
InChIKeyZTPKOAWAPJFPEU-UHFFFAOYSA-N
MW446.57 g/mol
LogP3.04
Rot. Bonds10

About N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2-(4-methoxyphenoxy)propanamide

N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2-(4-methoxyphenoxy)propanamide (PubChem CID 108736372) has the molecular formula C23H30N2O5S and a molecular weight of 446.57 g/mol. Its IUPAC name is N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2-(4-methoxyphenoxy)propanamide.

Molecular Properties

Compound NameN-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2-(4-methoxyphenoxy)propanamide
PubChem CID108736372
Molecular FormulaC23H30N2O5S
Molecular Weight446.57 g/mol
Exact Mass446.19
IUPAC NameN-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2-(4-methoxyphenoxy)propanamide
SMILESCOc1ccc(OC(C)C(=O)NCCc2ccc(S(=O)(=O)NC3CCCC3)cc2)cc1
InChIInChI=1S/C23H30N2O5S/c1-17(30-21-11-9-20(29-2)10-12-21)23(26)24-16-15-18-7-13-22(14-8-18)31(27,28)25-19-5-3-4-6-19/h7-14,17,19,25H,3-6,15-16H2,1-2H3,(H,24,26)
InChIKeyZTPKOAWAPJFPEU-UHFFFAOYSA-N
XLogP3.04
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500446.57
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[4-(cyclopentylsulfamoyl)phenoxy]-N-[2-(4-methoxyphenyl)ethyl]acetamide
CID 45374111
(2R)-2-[4-(cyclohexylsulfamoyl)phenoxy]-N-methylpropanamide
CID 92513134
methyl 4-[1-[2-(4-methoxyphenyl)ethylamino]-1-oxopropan-2-yl]oxybenzoate
CID 24511118
N-[2-(4-methoxyphenyl)ethyl]-2-(4-propan-2-ylphenoxy)propanamide
CID 24511975
2-(4-tert-butylphenoxy)-N-[2-(4-methoxyphenyl)ethyl]propanamide
CID 2960859
2-[3-[4-(cyclopropylsulfamoyl)phenyl]propanoyl-[(4-methoxyphenyl)methyl]amino]-N-methylpropanamide
CID 133213419
2-[4-(cyclohexylsulfamoyl)phenoxy]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
CID 45374682
N-[2-(4-methoxyphenyl)ethyl]-2-(4-propanoylphenoxy)propanamide
CID 24511404
(2R)-N-[2-(4-methoxyphenyl)ethyl]-2-[4-[methyl(methylsulfonyl)amino]phenoxy]propanamide
CID 100768119
N-[4-(cyclohexylsulfamoyl)phenyl]-2-phenoxypropanamide
CID 2973953
2-(4-methoxyphenoxy)-N-[2-[4-(trifluoromethyl)phenyl]ethyl]propanamide
CID 55504113
3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 27548348

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2-(4-methoxyphenoxy)propanamide?
The IUPAC name of N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2-(4-methoxyphenoxy)propanamide (CID 108736372) is N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2-(4-methoxyphenoxy)propanamide.
What is the SMILES notation for N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2-(4-methoxyphenoxy)propanamide?
The canonical SMILES for N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2-(4-methoxyphenoxy)propanamide is COc1ccc(OC(C)C(=O)NCCc2ccc(S(=O)(=O)NC3CCCC3)cc2)cc1.
What is the InChIKey of N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2-(4-methoxyphenoxy)propanamide?
The InChIKey is ZTPKOAWAPJFPEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H30N2O5S/c1-17(30-21-11-9-20(29-2)10-12-21)23(26)24-16-15-18-7-13-22(14-8-18)31(27,28)25-19-5-3-4-6-19/h7-14,17,19,25H,3-6,15-16H2,1-2H3,(H,24,26).
What are the key properties of N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2-(4-methoxyphenoxy)propanamide?
N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2-(4-methoxyphenoxy)propanamide has a molecular weight of 446.57 g/mol, XLogP of 3.04, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(cyclopentylsulfamoyl)phenyl]ethyl]-2-(4-methoxyphenoxy)propanamide is sourced from PubChem (CID 108736372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).