N-cyclopropyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide

C16H25N3O3S — CID 113156212

IUPACN-cyclopropyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide
SMILESCCN(CC)c1ccc(N(CC(=O)NC2CC2)S(C)(=O)=O)cc1
InChIInChI=1S/C16H25N3O3S/c1-4-18(5-2)14-8-10-15(11-9-14)19(23(3,21)22)12-16(20)17-13-6-7-13/h8-11,13H,4-7,12H2,1-3H3,(H,17,20)
InChIKeyFXUAPJRCRWDGBR-UHFFFAOYSA-N
MW339.46 g/mol
LogP1.58
Rot. Bonds8

About N-cyclopropyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide

N-cyclopropyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide (PubChem CID 113156212) has the molecular formula C16H25N3O3S and a molecular weight of 339.46 g/mol. Its IUPAC name is N-cyclopropyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide
PubChem CID113156212
Molecular FormulaC16H25N3O3S
Molecular Weight339.46 g/mol
Exact Mass339.16
IUPAC NameN-cyclopropyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide
SMILESCCN(CC)c1ccc(N(CC(=O)NC2CC2)S(C)(=O)=O)cc1
InChIInChI=1S/C16H25N3O3S/c1-4-18(5-2)14-8-10-15(11-9-14)19(23(3,21)22)12-16(20)17-13-6-7-13/h8-11,13H,4-7,12H2,1-3H3,(H,17,20)
InChIKeyFXUAPJRCRWDGBR-UHFFFAOYSA-N
XLogP1.58
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.46
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

Analyze N-cyclopropyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopentyl-2-[4-(diethylamino)-2-methyl-N-methylsulfonylanilino]acetamide
CID 113157058
2-[N-acetyl-4-(diethylamino)anilino]-N-cyclopropylacetamide
CID 113176819
N-cycloheptyl-2-(4-methoxy-N-methylsulfonylanilino)acetamide
CID 113155209
methyl 4-[[2-(cycloheptylamino)-2-oxoethyl]-methylsulfonylamino]benzoate
CID 113156039
N-benzyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide
CID 113156230
methyl 3-[[2-(cyclopropylamino)-2-oxoethyl]-methylsulfonylamino]benzoate
CID 113155927
N-cyclopropyl-2-(2-ethyl-6-methyl-N-methylsulfonylanilino)acetamide
CID 113154205
2-(3-bromo-N-methylsulfonylanilino)-N-cyclopentylacetamide
CID 999619
2-(3-chloro-4-methyl-N-methylsulfonylanilino)-N-cycloheptylacetamide
CID 113154945
N-(1,1-dioxothiolan-3-yl)-2-(4-ethoxy-N-methylsulfonylanilino)acetamide
CID 113155273
N-cyclopropyl-2-[N-methylsulfonyl-2,6-di(propan-2-yl)anilino]acetamide
CID 113156587
N-cyclopropyl-2-(2,5-dimethyl-N-methylsulfonylanilino)acetamide
CID 816090

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide?
The IUPAC name of N-cyclopropyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide (CID 113156212) is N-cyclopropyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide.
What is the SMILES notation for N-cyclopropyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide?
The canonical SMILES for N-cyclopropyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide is CCN(CC)c1ccc(N(CC(=O)NC2CC2)S(C)(=O)=O)cc1.
What is the InChIKey of N-cyclopropyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide?
The InChIKey is FXUAPJRCRWDGBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O3S/c1-4-18(5-2)14-8-10-15(11-9-14)19(23(3,21)22)12-16(20)17-13-6-7-13/h8-11,13H,4-7,12H2,1-3H3,(H,17,20).
What are the key properties of N-cyclopropyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide?
N-cyclopropyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide has a molecular weight of 339.46 g/mol, XLogP of 1.58, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[4-(diethylamino)-N-methylsulfonylanilino]acetamide is sourced from PubChem (CID 113156212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).