N-(3,3-diphenylpropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide

C25H28N2O4S2 — CID 5037436

IUPACN-(3,3-diphenylpropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
SMILESO=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NCCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H28N2O4S2/c28-24(19-22-11-12-25(32-22)33(29,30)27-15-17-31-18-16-27)26-14-13-23(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-12,23H,13-19H2,(H,26,28)
InChIKeyLCDGTCMXJBPYGQ-UHFFFAOYSA-N
MW484.64 g/mol
LogP3.65
Rot. Bonds9

About N-(3,3-diphenylpropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide

N-(3,3-diphenylpropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide (PubChem CID 5037436) has the molecular formula C25H28N2O4S2 and a molecular weight of 484.64 g/mol. Its IUPAC name is N-(3,3-diphenylpropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide.

Molecular Properties

Compound NameN-(3,3-diphenylpropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
PubChem CID5037436
Molecular FormulaC25H28N2O4S2
Molecular Weight484.64 g/mol
Exact Mass484.15
IUPAC NameN-(3,3-diphenylpropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
SMILESO=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NCCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H28N2O4S2/c28-24(19-22-11-12-25(32-22)33(29,30)27-15-17-31-18-16-27)26-14-13-23(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-12,23H,13-19H2,(H,26,28)
InChIKeyLCDGTCMXJBPYGQ-UHFFFAOYSA-N
XLogP3.65
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.64
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-phenylethyl)-4-{[(thien-2-ylsulfonyl)amino]methyl}cyclohexanecarboxamide
CID 15997729
N-(2-phenylethyl)-1-thiophen-2-ylsulfonylpiperidine-3-carboxamide
CID 5308267
[2-(Benzylamino)-2-oxoethyl] 2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetate
CID 2355400
[2-Oxo-2-(2-phenylethylamino)ethyl] 2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetate
CID 4373090
N1-phenethyl-N2-((3-(thiophen-2-ylsulfonyl)-1,3-oxazinan-2-yl)methyl)oxalamide
CID 18561610
1-[4-(4-Methylphenyl)sulfonylpiperazin-1-yl]-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)ethanone
CID 24818090
N-[1-[4-(2-methylpropyl)phenyl]ethyl]-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
CID 24980169
N-[(4-tert-butylphenyl)methyl]-N-methyl-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
CID 25162392
N-butyloxycarbonyl-3-[4-(N-benzylcarbamoylmethyl)phenyl]-5-iso-butylthiophene-2-sulfonamide
CID 44437990
butyl N-[5-(2-methylpropyl)-3-[4-(2-morpholin-4-yl-2-oxoethyl)phenyl]thiophen-2-yl]sulfonylcarbamate
CID 44437993
N-butyloxycarbonyl-3-[4-(N-hexylcarbamoylmethyl)phenyl]-5-iso-butylthiophene-2-sulfonamide
CID 44437996
N-(5-methylhexan-2-yl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
CID 24819930

Frequently Asked Questions

What is the IUPAC name of N-(3,3-diphenylpropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide?
The IUPAC name of N-(3,3-diphenylpropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide (CID 5037436) is N-(3,3-diphenylpropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide.
What is the SMILES notation for N-(3,3-diphenylpropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide?
The canonical SMILES for N-(3,3-diphenylpropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide is O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NCCC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(3,3-diphenylpropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide?
The InChIKey is LCDGTCMXJBPYGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N2O4S2/c28-24(19-22-11-12-25(32-22)33(29,30)27-15-17-31-18-16-27)26-14-13-23(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-12,23H,13-19H2,(H,26,28).
What are the key properties of N-(3,3-diphenylpropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide?
N-(3,3-diphenylpropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide has a molecular weight of 484.64 g/mol, XLogP of 3.65, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-diphenylpropyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide is sourced from PubChem (CID 5037436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).