N-[2-(2-methylphenyl)ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide

C22H24N2O3S — CID 17486148

IUPACN-[2-(2-methylphenyl)ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide
SMILESCc1ccccc1CCNC(=O)CCNS(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C22H24N2O3S/c1-17-6-2-3-7-18(17)12-14-23-22(25)13-15-24-28(26,27)21-11-10-19-8-4-5-9-20(19)16-21/h2-11,16,24H,12-15H2,1H3,(H,23,25)
InChIKeyZANCYSJPHGQLSL-UHFFFAOYSA-N
MW396.51 g/mol
LogP3.18
Rot. Bonds8

About N-[2-(2-methylphenyl)ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide

N-[2-(2-methylphenyl)ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide (PubChem CID 17486148) has the molecular formula C22H24N2O3S and a molecular weight of 396.51 g/mol. Its IUPAC name is N-[2-(2-methylphenyl)ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide.

Molecular Properties

Compound NameN-[2-(2-methylphenyl)ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide
PubChem CID17486148
Molecular FormulaC22H24N2O3S
Molecular Weight396.51 g/mol
Exact Mass396.15
IUPAC NameN-[2-(2-methylphenyl)ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide
SMILESCc1ccccc1CCNC(=O)CCNS(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C22H24N2O3S/c1-17-6-2-3-7-18(17)12-14-23-22(25)13-15-24-28(26,27)21-11-10-19-8-4-5-9-20(19)16-21/h2-11,16,24H,12-15H2,1H3,(H,23,25)
InChIKeyZANCYSJPHGQLSL-UHFFFAOYSA-N
XLogP3.18
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.51
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-(2-methylphenyl)ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide 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-methyl-3-(naphthalen-2-ylsulfonylamino)propanamide
CID 47101384
3-(naphthalen-2-ylsulfonylamino)-N-[2-(pyrimidin-2-ylamino)ethyl]propanamide
CID 55647229
N-[2-[5-(2-methyl-1,3-thiazol-4-yl)thiophen-2-yl]ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide
CID 42575279
3-[(3,4-difluorophenyl)sulfonylamino]-N-[2-(2-fluorophenyl)ethyl]propanamide
CID 24547426
3-(naphthalen-2-ylsulfonylamino)-N-phenylpropanamide
CID 9340894
3-(naphthalen-2-ylsulfonylamino)-N-(4-phenylbutan-2-yl)propanamide
CID 46522158
3-(naphthalen-2-ylsulfonylamino)-N-(3-oxo-3-pyrrolidin-1-ylpropyl)propanamide
CID 17459741
(2S)-2-[3-(naphthalen-2-ylsulfonylamino)propanoylamino]propanoic acid
CID 119238107
N-[(3-methoxyphenyl)methyl]-3-(naphthalen-2-ylsulfonylamino)propanamide
CID 9495720
2-(2,6-dimethylphenoxy)ethyl 3-(naphthalen-2-ylsulfonylamino)propanoate
CID 16516055
N-[2-(naphthalen-2-ylsulfonylamino)ethyl]naphthalene-2-sulfonamide
CID 30170513
N-methyl-4-[[3-(naphthalen-2-ylsulfonylamino)propanoylamino]methyl]-N-propan-2-ylbenzamide
CID 55636084

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methylphenyl)ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide?
The IUPAC name of N-[2-(2-methylphenyl)ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide (CID 17486148) is N-[2-(2-methylphenyl)ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide.
What is the SMILES notation for N-[2-(2-methylphenyl)ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide?
The canonical SMILES for N-[2-(2-methylphenyl)ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide is Cc1ccccc1CCNC(=O)CCNS(=O)(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-[2-(2-methylphenyl)ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide?
The InChIKey is ZANCYSJPHGQLSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3S/c1-17-6-2-3-7-18(17)12-14-23-22(25)13-15-24-28(26,27)21-11-10-19-8-4-5-9-20(19)16-21/h2-11,16,24H,12-15H2,1H3,(H,23,25).
What are the key properties of N-[2-(2-methylphenyl)ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide?
N-[2-(2-methylphenyl)ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide has a molecular weight of 396.51 g/mol, XLogP of 3.18, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methylphenyl)ethyl]-3-(naphthalen-2-ylsulfonylamino)propanamide is sourced from PubChem (CID 17486148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).