N-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide

C12H17NO3S — CID 110759510

IUPACN-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide
SMILESCOc1cc(C)cc(C)c1S(=O)(=O)NC1CC1
InChIInChI=1S/C12H17NO3S/c1-8-6-9(2)12(11(7-8)16-3)17(14,15)13-10-4-5-10/h6-7,10,13H,4-5H2,1-3H3
InChIKeyLIPPATREHNYJCN-UHFFFAOYSA-N
MW255.34 g/mol
LogP1.75
Rot. Bonds4

About N-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide

N-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide (PubChem CID 110759510) has the molecular formula C12H17NO3S and a molecular weight of 255.34 g/mol. Its IUPAC name is N-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide
PubChem CID110759510
Molecular FormulaC12H17NO3S
Molecular Weight255.34 g/mol
Exact Mass255.09
IUPAC NameN-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide
SMILESCOc1cc(C)cc(C)c1S(=O)(=O)NC1CC1
InChIInChI=1S/C12H17NO3S/c1-8-6-9(2)12(11(7-8)16-3)17(14,15)13-10-4-5-10/h6-7,10,13H,4-5H2,1-3H3
InChIKeyLIPPATREHNYJCN-UHFFFAOYSA-N
XLogP1.75
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.34
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide 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

2,4,6-trimethyl-N-[4-[[4-[(2,4,6-trimethylphenyl)sulfonylamino]cyclohexyl]methyl]cyclohexyl]benzenesulfonamide
CID 46192720
N-(2-amino-1-cyclopentylethyl)-2-methoxy-4,6-dimethylbenzenesulfonamide
CID 120713602
2-methoxy-4,6-dimethyl-N-(2-methylpiperidin-3-yl)benzenesulfonamide;hydrochloride
CID 120726218
N-(1,1-dioxothiolan-3-yl)-2,4,6-trimethylbenzenesulfonamide
CID 45154252
N-cyclopropyl-4-hydroxy-2,6-dimethylbenzenesulfonamide
CID 91800483
2,4,6-trimethyl-N-[1-(2,4,6-trimethylphenyl)sulfonylpiperidin-4-yl]benzenesulfonamide
CID 10552105
N-(2-amino-2-methylpropyl)-2-methoxy-4,6-dimethylbenzenesulfonamide
CID 120711475
N-cyclohexyl-2,5-dimethoxy-4-methylbenzenesulfonamide
CID 6464098
N-cyclopentyl-2-methoxy-4-methylbenzenesulfonamide
CID 172906018
4-methoxy-2,6-dimethyl-N-piperidin-4-ylbenzenesulfonamide;hydrochloride
CID 167945506
2-methoxy-4,6-dimethyl-N-(3-methylbutyl)benzenesulfonamide
CID 110759544
(2S)-2-[(2-methoxy-4,6-dimethylphenyl)sulfonylamino]propanoic acid
CID 98026813

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide?
The IUPAC name of N-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide (CID 110759510) is N-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide.
What is the SMILES notation for N-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide?
The canonical SMILES for N-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide is COc1cc(C)cc(C)c1S(=O)(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide?
The InChIKey is LIPPATREHNYJCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3S/c1-8-6-9(2)12(11(7-8)16-3)17(14,15)13-10-4-5-10/h6-7,10,13H,4-5H2,1-3H3.
What are the key properties of N-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide?
N-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide has a molecular weight of 255.34 g/mol, XLogP of 1.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-methoxy-4,6-dimethylbenzenesulfonamide is sourced from PubChem (CID 110759510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).