N-[2-(dimethylamino)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide

C14H23N3O3S — CID 112991485

IUPACN-[2-(dimethylamino)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide
SMILESCCc1ccc(S(=O)(=O)NCC(=O)NCCN(C)C)cc1
InChIInChI=1S/C14H23N3O3S/c1-4-12-5-7-13(8-6-12)21(19,20)16-11-14(18)15-9-10-17(2)3/h5-8,16H,4,9-11H2,1-3H3,(H,15,18)
InChIKeyUBXZVDMICNBSKD-UHFFFAOYSA-N
MW313.42 g/mol
LogP0.21
Rot. Bonds8

About N-[2-(dimethylamino)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide

N-[2-(dimethylamino)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide (PubChem CID 112991485) has the molecular formula C14H23N3O3S and a molecular weight of 313.42 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide
PubChem CID112991485
Molecular FormulaC14H23N3O3S
Molecular Weight313.42 g/mol
Exact Mass313.15
IUPAC NameN-[2-(dimethylamino)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide
SMILESCCc1ccc(S(=O)(=O)NCC(=O)NCCN(C)C)cc1
InChIInChI=1S/C14H23N3O3S/c1-4-12-5-7-13(8-6-12)21(19,20)16-11-14(18)15-9-10-17(2)3/h5-8,16H,4,9-11H2,1-3H3,(H,15,18)
InChIKeyUBXZVDMICNBSKD-UHFFFAOYSA-N
XLogP0.21
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.42
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-ethylphenyl)sulfonylamino]-N-pentylacetamide
CID 112995294
2-[(3,4-dichlorophenyl)sulfonylamino]-N-[2-(dimethylamino)ethyl]acetamide
CID 112991491
N-[2-[(4-ethylphenyl)sulfonylamino]ethyl]propanamide
CID 108574101
N-[3-(dimethylamino)propyl]-2-[(4-methoxyphenyl)sulfonylamino]acetamide
CID 112991615
2-(1,3-benzodioxol-5-ylsulfonylamino)-N-[2-(dimethylamino)ethyl]acetamide
CID 112991498
2-[(4-ethylphenyl)sulfonylamino]acetic acid
CID 757399
N-[2-(3-chlorophenyl)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide
CID 112995868
2-[(5-bromothiophen-2-yl)sulfonylamino]-N-[2-(dimethylamino)ethyl]acetamide
CID 112991518
4-[3-(dimethylamino)propylsulfamoyl]-N-(4-ethylphenyl)benzamide
CID 109060317
2-[(4-chloro-3-methylphenyl)sulfonylamino]-N-[3-(dimethylamino)propyl]acetamide
CID 112991642
N-[2-(dimethylamino)ethyl]-4-(3-hydroxypropyl)benzenesulfonamide
CID 39387794
N-(4-bromophenyl)-2-[(4-ethylphenyl)sulfonylamino]acetamide
CID 112998475

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide (CID 112991485) is N-[2-(dimethylamino)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide is CCc1ccc(S(=O)(=O)NCC(=O)NCCN(C)C)cc1.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide?
The InChIKey is UBXZVDMICNBSKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3S/c1-4-12-5-7-13(8-6-12)21(19,20)16-11-14(18)15-9-10-17(2)3/h5-8,16H,4,9-11H2,1-3H3,(H,15,18).
What are the key properties of N-[2-(dimethylamino)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide?
N-[2-(dimethylamino)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide has a molecular weight of 313.42 g/mol, XLogP of 0.21, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-[(4-ethylphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 112991485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).