N-[4-(dipropylsulfamoyl)phenyl]-2-(4-phenylphenoxy)propanamide

C27H32N2O4S — CID 4951795

IUPACN-[4-(dipropylsulfamoyl)phenyl]-2-(4-phenylphenoxy)propanamide
SMILESCCCN(CCC)S(=O)(=O)c1ccc(NC(=O)C(C)Oc2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C27H32N2O4S/c1-4-19-29(20-5-2)34(31,32)26-17-13-24(14-18-26)28-27(30)21(3)33-25-15-11-23(12-16-25)22-9-7-6-8-10-22/h6-18,21H,4-5,19-20H2,1-3H3,(H,28,30)
InChIKeyCONCWWYKHKIURU-UHFFFAOYSA-N
MW480.63 g/mol
LogP5.57
Rot. Bonds11

About N-[4-(dipropylsulfamoyl)phenyl]-2-(4-phenylphenoxy)propanamide

N-[4-(dipropylsulfamoyl)phenyl]-2-(4-phenylphenoxy)propanamide (PubChem CID 4951795) has the molecular formula C27H32N2O4S and a molecular weight of 480.63 g/mol. Its IUPAC name is N-[4-(dipropylsulfamoyl)phenyl]-2-(4-phenylphenoxy)propanamide.

Molecular Properties

Compound NameN-[4-(dipropylsulfamoyl)phenyl]-2-(4-phenylphenoxy)propanamide
PubChem CID4951795
Molecular FormulaC27H32N2O4S
Molecular Weight480.63 g/mol
Exact Mass480.21
IUPAC NameN-[4-(dipropylsulfamoyl)phenyl]-2-(4-phenylphenoxy)propanamide
SMILESCCCN(CCC)S(=O)(=O)c1ccc(NC(=O)C(C)Oc2ccc(-c3ccccc3)cc2)cc1
InChIInChI=1S/C27H32N2O4S/c1-4-19-29(20-5-2)34(31,32)26-17-13-24(14-18-26)28-27(30)21(3)33-25-15-11-23(12-16-25)22-9-7-6-8-10-22/h6-18,21H,4-5,19-20H2,1-3H3,(H,28,30)
InChIKeyCONCWWYKHKIURU-UHFFFAOYSA-N
XLogP5.57
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500480.63
LogP ≤ 55.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-(dipropylsulfamoyl)phenyl]-2-(4-propan-2-ylphenoxy)propanamide
CID 4953686
N-[4-(dipropylsulfamoyl)phenyl]-2-(2-methoxyphenoxy)propanamide
CID 4943258
N-phenyl-2-(4-phenylphenoxy)propanamide
CID 2969640
N-[4-(benzylsulfamoyl)phenyl]-2-(4-phenylphenoxy)propanamide
CID 4951794
2-(4-phenylphenoxy)-N-[4-(pyrimidin-2-ylsulfamoyl)phenyl]propanamide
CID 2968466
N-(4-methoxyphenyl)-2-(4-phenylphenoxy)propanamide
CID 4951720
N-[4-[ethyl(phenyl)sulfamoyl]phenyl]-2-(4-methoxyphenoxy)propanamide
CID 4942716
2-(4-ethylphenoxy)-N-[4-[methyl(phenyl)sulfamoyl]phenyl]propanamide
CID 4953352
(2S)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2-(4-methylphenoxy)propanamide
CID 2238568
2-(4-ethylphenoxy)-N-[4-[ethyl(phenyl)sulfamoyl]phenyl]propanamide
CID 4953267
(2R)-N-[4-(diethylsulfamoyl)phenyl]-2-(3,4-dimethylphenoxy)propanamide
CID 40768898
N-[4-[bis(prop-2-enyl)sulfamoyl]phenyl]-2-(4-tert-butylphenoxy)propanamide
CID 17046295

Frequently Asked Questions

What is the IUPAC name of N-[4-(dipropylsulfamoyl)phenyl]-2-(4-phenylphenoxy)propanamide?
The IUPAC name of N-[4-(dipropylsulfamoyl)phenyl]-2-(4-phenylphenoxy)propanamide (CID 4951795) is N-[4-(dipropylsulfamoyl)phenyl]-2-(4-phenylphenoxy)propanamide.
What is the SMILES notation for N-[4-(dipropylsulfamoyl)phenyl]-2-(4-phenylphenoxy)propanamide?
The canonical SMILES for N-[4-(dipropylsulfamoyl)phenyl]-2-(4-phenylphenoxy)propanamide is CCCN(CCC)S(=O)(=O)c1ccc(NC(=O)C(C)Oc2ccc(-c3ccccc3)cc2)cc1.
What is the InChIKey of N-[4-(dipropylsulfamoyl)phenyl]-2-(4-phenylphenoxy)propanamide?
The InChIKey is CONCWWYKHKIURU-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H32N2O4S/c1-4-19-29(20-5-2)34(31,32)26-17-13-24(14-18-26)28-27(30)21(3)33-25-15-11-23(12-16-25)22-9-7-6-8-10-22/h6-18,21H,4-5,19-20H2,1-3H3,(H,28,30).
What are the key properties of N-[4-(dipropylsulfamoyl)phenyl]-2-(4-phenylphenoxy)propanamide?
N-[4-(dipropylsulfamoyl)phenyl]-2-(4-phenylphenoxy)propanamide has a molecular weight of 480.63 g/mol, XLogP of 5.57, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(dipropylsulfamoyl)phenyl]-2-(4-phenylphenoxy)propanamide is sourced from PubChem (CID 4951795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).