N-(3-chlorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide

C17H19ClN2O3S — CID 112997895

IUPACN-(3-chlorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide
SMILESO=C(CNS(=O)(=O)CCCc1ccccc1)Nc1cccc(Cl)c1
InChIInChI=1S/C17H19ClN2O3S/c18-15-9-4-10-16(12-15)20-17(21)13-19-24(22,23)11-5-8-14-6-2-1-3-7-14/h1-4,6-7,9-10,12,19H,5,8,11,13H2,(H,20,21)
InChIKeyWRWTWCNXNJMQLL-UHFFFAOYSA-N
MW366.87 g/mol
LogP2.83
Rot. Bonds8

About N-(3-chlorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide

N-(3-chlorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide (PubChem CID 112997895) has the molecular formula C17H19ClN2O3S and a molecular weight of 366.87 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide
PubChem CID112997895
Molecular FormulaC17H19ClN2O3S
Molecular Weight366.87 g/mol
Exact Mass366.08
IUPAC NameN-(3-chlorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide
SMILESO=C(CNS(=O)(=O)CCCc1ccccc1)Nc1cccc(Cl)c1
InChIInChI=1S/C17H19ClN2O3S/c18-15-9-4-10-16(12-15)20-17(21)13-19-24(22,23)11-5-8-14-6-2-1-3-7-14/h1-4,6-7,9-10,12,19H,5,8,11,13H2,(H,20,21)
InChIKeyWRWTWCNXNJMQLL-UHFFFAOYSA-N
XLogP2.83
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.87
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-chloro-4-fluorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide
CID 110285381
N-(1,3-benzodioxol-5-yl)-2-(3-phenylpropylsulfonylamino)acetamide
CID 110370518
2-[(4-bromophenyl)methylsulfonylamino]-N-(3-chlorophenyl)acetamide
CID 22300056
methyl 4-[[2-(3-phenylpropylsulfonylamino)acetyl]amino]benzoate
CID 112999988
2-(butylsulfonylamino)-N-[2-(3-chlorophenyl)ethyl]acetamide
CID 112995859
4-(benzenesulfonyl)-N-(3-chlorophenyl)butanamide
CID 41273157
2-[(4-chlorophenyl)methylsulfonylamino]-N-phenylacetamide
CID 51711268
N-(2-methoxyphenyl)-2-(3-phenylpropylsulfonylamino)acetamide
CID 112998607
3-(3-chlorophenyl)-N-phenylpropanamide
CID 1407295
N-(3-chlorophenyl)-2-[3-(2-phenylethoxy)anilino]acetamide
CID 54828339
N,N'-bis(3-chlorophenyl)pentanediamide
CID 1011389
N-(3-chlorophenyl)-2-[3-(methanesulfonamido)propylamino]acetamide
CID 103820258

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide?
The IUPAC name of N-(3-chlorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide (CID 112997895) is N-(3-chlorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide is O=C(CNS(=O)(=O)CCCc1ccccc1)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide?
The InChIKey is WRWTWCNXNJMQLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2O3S/c18-15-9-4-10-16(12-15)20-17(21)13-19-24(22,23)11-5-8-14-6-2-1-3-7-14/h1-4,6-7,9-10,12,19H,5,8,11,13H2,(H,20,21).
What are the key properties of N-(3-chlorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide?
N-(3-chlorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide has a molecular weight of 366.87 g/mol, XLogP of 2.83, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-(3-phenylpropylsulfonylamino)acetamide is sourced from PubChem (CID 112997895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).