N-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-phenylbutanamide

C19H23FN2O3S — CID 55363261

IUPACN-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-phenylbutanamide
SMILESCCN(C(=O)CCCN(C)S(=O)(=O)c1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C19H23FN2O3S/c1-3-22(17-8-5-4-6-9-17)19(23)10-7-15-21(2)26(24,25)18-13-11-16(20)12-14-18/h4-6,8-9,11-14H,3,7,10,15H2,1-2H3
InChIKeyQJHRBPKVPQGZMV-UHFFFAOYSA-N
MW378.47 g/mol
LogP3.28
Rot. Bonds8

About N-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-phenylbutanamide

N-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-phenylbutanamide (PubChem CID 55363261) has the molecular formula C19H23FN2O3S and a molecular weight of 378.47 g/mol. Its IUPAC name is N-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-phenylbutanamide.

Molecular Properties

Compound NameN-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-phenylbutanamide
PubChem CID55363261
Molecular FormulaC19H23FN2O3S
Molecular Weight378.47 g/mol
Exact Mass378.14
IUPAC NameN-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-phenylbutanamide
SMILESCCN(C(=O)CCCN(C)S(=O)(=O)c1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C19H23FN2O3S/c1-3-22(17-8-5-4-6-9-17)19(23)10-7-15-21(2)26(24,25)18-13-11-16(20)12-14-18/h4-6,8-9,11-14H,3,7,10,15H2,1-2H3
InChIKeyQJHRBPKVPQGZMV-UHFFFAOYSA-N
XLogP3.28
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.47
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-phenylbutanamide 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

4-[(4-fluorophenyl)sulfonyl-methylamino]-N-methyl-N-phenylbutanamide
CID 39753065
N-(3,4-difluorophenyl)-N-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]butanamide
CID 55592039
4-[(4-fluorophenyl)sulfonyl-methylamino]-N-methyl-N-(1-phenylethyl)butanamide
CID 51188184
2-[butan-2-yl-[4-[(4-fluorophenyl)sulfonyl-methylamino]butanoyl]amino]acetic acid
CID 119954928
N-ethyl-N-(4-fluorophenyl)hexanamide
CID 78806862
N-ethyl-2-[(4-fluorophenyl)sulfonyl-methylamino]-N-naphthalen-1-ylacetamide
CID 2442734
N-ethyl-N-phenyloctadecanamide
CID 151424183
4-amino-N-ethyl-N-phenylbutanamide;hydrochloride
CID 119261842
N-(2-benzylsulfanylphenyl)-4-[(4-fluorophenyl)sulfonyl-methylamino]butanamide
CID 16561464
N-(1,3-benzothiazol-2-ylmethyl)-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-methylbutanamide
CID 31734194
N-ethyl-N-(4-fluorophenyl)-4-methoxybutanamide
CID 78883434
N-(1-benzylpyrrolidin-3-yl)-4-[(4-fluorophenyl)sulfonyl-methylamino]butanamide
CID 46684557

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-phenylbutanamide?
The IUPAC name of N-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-phenylbutanamide (CID 55363261) is N-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-phenylbutanamide.
What is the SMILES notation for N-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-phenylbutanamide?
The canonical SMILES for N-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-phenylbutanamide is CCN(C(=O)CCCN(C)S(=O)(=O)c1ccc(F)cc1)c1ccccc1.
What is the InChIKey of N-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-phenylbutanamide?
The InChIKey is QJHRBPKVPQGZMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O3S/c1-3-22(17-8-5-4-6-9-17)19(23)10-7-15-21(2)26(24,25)18-13-11-16(20)12-14-18/h4-6,8-9,11-14H,3,7,10,15H2,1-2H3.
What are the key properties of N-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-phenylbutanamide?
N-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-phenylbutanamide has a molecular weight of 378.47 g/mol, XLogP of 3.28, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[(4-fluorophenyl)sulfonyl-methylamino]-N-phenylbutanamide is sourced from PubChem (CID 55363261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).