2-amino-6-methyl-N-(2-methylcyclopropyl)benzenesulfonamide

C11H16N2O2S — CID 62397102

IUPAC2-amino-6-methyl-N-(2-methylcyclopropyl)benzenesulfonamide
SMILESCc1cccc(N)c1S(=O)(=O)NC1CC1C
InChIInChI=1S/C11H16N2O2S/c1-7-4-3-5-9(12)11(7)16(14,15)13-10-6-8(10)2/h3-5,8,10,13H,6,12H2,1-2H3
InChIKeyKTOLHLGNBSXAST-UHFFFAOYSA-N
MW240.33 g/mol
LogP1.26
Rot. Bonds3

About 2-amino-6-methyl-N-(2-methylcyclopropyl)benzenesulfonamide

2-amino-6-methyl-N-(2-methylcyclopropyl)benzenesulfonamide (PubChem CID 62397102) has the molecular formula C11H16N2O2S and a molecular weight of 240.33 g/mol. Its IUPAC name is 2-amino-6-methyl-N-(2-methylcyclopropyl)benzenesulfonamide.

Molecular Properties

Compound Name2-amino-6-methyl-N-(2-methylcyclopropyl)benzenesulfonamide
PubChem CID62397102
Molecular FormulaC11H16N2O2S
Molecular Weight240.33 g/mol
Exact Mass240.09
IUPAC Name2-amino-6-methyl-N-(2-methylcyclopropyl)benzenesulfonamide
SMILESCc1cccc(N)c1S(=O)(=O)NC1CC1C
InChIInChI=1S/C11H16N2O2S/c1-7-4-3-5-9(12)11(7)16(14,15)13-10-6-8(10)2/h3-5,8,10,13H,6,12H2,1-2H3
InChIKeyKTOLHLGNBSXAST-UHFFFAOYSA-N
XLogP1.26
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-N-cyclopropyl-6-methylbenzenesulfonamide
CID 43452334
3-amino-2,5,6-trimethyl-N-(2-methylcyclopropyl)benzenesulfonamide
CID 106504779
2-amino-N-(4-ethylcyclohexyl)-6-methylbenzenesulfonamide
CID 61466874
2-amino-6-methyl-N-propylbenzenesulfonamide
CID 43452324
2-amino-6-methyl-N-[(3-methylcyclopentyl)methyl]benzenesulfonamide
CID 107411164
2-amino-N',N',6-trimethylbenzenesulfonohydrazide
CID 83013451
2-amino-N-(1-cyclohexylethyl)-6-methylbenzenesulfonamide
CID 62407142
2-amino-6-methyl-N-prop-2-ynylbenzenesulfonamide
CID 61112321
2-amino-N,6-dimethyl-N-(4-methylcyclohexyl)benzenesulfonamide
CID 61104917
2-amino-N-(3-bromophenyl)-6-methylbenzenesulfonamide
CID 43452387
2-amino-6-methyl-N-(4-methylpiperazin-1-yl)benzenesulfonamide
CID 83012362
2-amino-N-(2-cyclopropyl-2-hydroxyethyl)-6-methylbenzenesulfonamide
CID 63294178

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-methyl-N-(2-methylcyclopropyl)benzenesulfonamide?
The IUPAC name of 2-amino-6-methyl-N-(2-methylcyclopropyl)benzenesulfonamide (CID 62397102) is 2-amino-6-methyl-N-(2-methylcyclopropyl)benzenesulfonamide.
What is the SMILES notation for 2-amino-6-methyl-N-(2-methylcyclopropyl)benzenesulfonamide?
The canonical SMILES for 2-amino-6-methyl-N-(2-methylcyclopropyl)benzenesulfonamide is Cc1cccc(N)c1S(=O)(=O)NC1CC1C.
What is the InChIKey of 2-amino-6-methyl-N-(2-methylcyclopropyl)benzenesulfonamide?
The InChIKey is KTOLHLGNBSXAST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2S/c1-7-4-3-5-9(12)11(7)16(14,15)13-10-6-8(10)2/h3-5,8,10,13H,6,12H2,1-2H3.
What are the key properties of 2-amino-6-methyl-N-(2-methylcyclopropyl)benzenesulfonamide?
2-amino-6-methyl-N-(2-methylcyclopropyl)benzenesulfonamide has a molecular weight of 240.33 g/mol, XLogP of 1.26, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-methyl-N-(2-methylcyclopropyl)benzenesulfonamide is sourced from PubChem (CID 62397102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).