2-[(2-methylphenyl)sulfonylamino]-N,N-dipropylacetamide

C15H24N2O3S — CID 112995821

IUPAC2-[(2-methylphenyl)sulfonylamino]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)CNS(=O)(=O)c1ccccc1C
InChIInChI=1S/C15H24N2O3S/c1-4-10-17(11-5-2)15(18)12-16-21(19,20)14-9-7-6-8-13(14)3/h6-9,16H,4-5,10-12H2,1-3H3
InChIKeyNQOMCFWDQZLHMC-UHFFFAOYSA-N
MW312.43 g/mol
LogP1.92
Rot. Bonds8

About 2-[(2-methylphenyl)sulfonylamino]-N,N-dipropylacetamide

2-[(2-methylphenyl)sulfonylamino]-N,N-dipropylacetamide (PubChem CID 112995821) has the molecular formula C15H24N2O3S and a molecular weight of 312.43 g/mol. Its IUPAC name is 2-[(2-methylphenyl)sulfonylamino]-N,N-dipropylacetamide.

Molecular Properties

Compound Name2-[(2-methylphenyl)sulfonylamino]-N,N-dipropylacetamide
PubChem CID112995821
Molecular FormulaC15H24N2O3S
Molecular Weight312.43 g/mol
Exact Mass312.15
IUPAC Name2-[(2-methylphenyl)sulfonylamino]-N,N-dipropylacetamide
SMILESCCCN(CCC)C(=O)CNS(=O)(=O)c1ccccc1C
InChIInChI=1S/C15H24N2O3S/c1-4-10-17(11-5-2)15(18)12-16-21(19,20)14-9-7-6-8-13(14)3/h6-9,16H,4-5,10-12H2,1-3H3
InChIKeyNQOMCFWDQZLHMC-UHFFFAOYSA-N
XLogP1.92
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.43
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(2-methylphenyl)sulfonylamino]-N,N-dipropylacetamide 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-[4-(diethylamino)-2-methylphenyl]-2-[(2-methylphenyl)sulfonylamino]acetamide
CID 113001706
N-(2-ethyl-6-methylphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide
CID 112997077
N-[2-[butyl(methylsulfonyl)amino]ethyl]-2-methylbenzenesulfonamide
CID 113065440
2-(2-methylphenyl)-N,N-dipropylacetamide
CID 86977350
2-[(2-methylphenyl)sulfonylamino]-N-(3-phenylpropyl)acetamide
CID 112994846
N-(4-chloro-2-methylphenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide
CID 112998153
N-butan-2-yl-N-[2-[(2-methylphenyl)sulfonylamino]ethyl]acetamide
CID 113052766
N-(4-chlorophenyl)-2-[(2-methylphenyl)sulfonylamino]acetamide
CID 112997960
N-(2-ethylsulfonylethyl)-2-methylbenzenesulfonamide
CID 103721105
N-(2-hydroxyethyl)-2-(2-methylphenyl)-N-propylacetamide
CID 60656670
2-[(2-methylphenyl)sulfonylamino]ethylurea
CID 83118355
2-methyl-N-[2-(propylamino)ethyl]benzenesulfonamide;hydrochloride
CID 120716521

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylphenyl)sulfonylamino]-N,N-dipropylacetamide?
The IUPAC name of 2-[(2-methylphenyl)sulfonylamino]-N,N-dipropylacetamide (CID 112995821) is 2-[(2-methylphenyl)sulfonylamino]-N,N-dipropylacetamide.
What is the SMILES notation for 2-[(2-methylphenyl)sulfonylamino]-N,N-dipropylacetamide?
The canonical SMILES for 2-[(2-methylphenyl)sulfonylamino]-N,N-dipropylacetamide is CCCN(CCC)C(=O)CNS(=O)(=O)c1ccccc1C.
What is the InChIKey of 2-[(2-methylphenyl)sulfonylamino]-N,N-dipropylacetamide?
The InChIKey is NQOMCFWDQZLHMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3S/c1-4-10-17(11-5-2)15(18)12-16-21(19,20)14-9-7-6-8-13(14)3/h6-9,16H,4-5,10-12H2,1-3H3.
What are the key properties of 2-[(2-methylphenyl)sulfonylamino]-N,N-dipropylacetamide?
2-[(2-methylphenyl)sulfonylamino]-N,N-dipropylacetamide has a molecular weight of 312.43 g/mol, XLogP of 1.92, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylphenyl)sulfonylamino]-N,N-dipropylacetamide is sourced from PubChem (CID 112995821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).