N-cyclopropyl-2-(cyclopropylamino)benzenesulfonamide

C12H16N2O2S — CID 43454646

IUPACN-cyclopropyl-2-(cyclopropylamino)benzenesulfonamide
SMILESO=S(=O)(NC1CC1)c1ccccc1NC1CC1
InChIInChI=1S/C12H16N2O2S/c15-17(16,14-10-7-8-10)12-4-2-1-3-11(12)13-9-5-6-9/h1-4,9-10,13-14H,5-8H2
InChIKeyHVWJFDJSZUTATB-UHFFFAOYSA-N
MW252.34 g/mol
LogP1.70
Rot. Bonds5

About N-cyclopropyl-2-(cyclopropylamino)benzenesulfonamide

N-cyclopropyl-2-(cyclopropylamino)benzenesulfonamide (PubChem CID 43454646) has the molecular formula C12H16N2O2S and a molecular weight of 252.34 g/mol. Its IUPAC name is N-cyclopropyl-2-(cyclopropylamino)benzenesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(cyclopropylamino)benzenesulfonamide
PubChem CID43454646
Molecular FormulaC12H16N2O2S
Molecular Weight252.34 g/mol
Exact Mass252.09
IUPAC NameN-cyclopropyl-2-(cyclopropylamino)benzenesulfonamide
SMILESO=S(=O)(NC1CC1)c1ccccc1NC1CC1
InChIInChI=1S/C12H16N2O2S/c15-17(16,14-10-7-8-10)12-4-2-1-3-11(12)13-9-5-6-9/h1-4,9-10,13-14H,5-8H2
InChIKeyHVWJFDJSZUTATB-UHFFFAOYSA-N
XLogP1.70
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.34
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(cycloheptylamino)-N-cyclopropylbenzenesulfonamide
CID 43454674
N-cyclopropyl-2-[(4-methylcyclohexyl)amino]benzenesulfonamide
CID 43454668
2-(cyclopropylamino)-N-methylbenzenesulfonamide
CID 43454291
2-(3-azabicyclo[3.1.0]hexan-6-ylamino)-N-cyclopropylbenzenesulfonamide
CID 43599036
N-cyclopropyl-2-[2-(cyclopropylamino)ethylamino]benzenesulfonamide
CID 62663053
N-cyclopropyl-2-(2,2-dimethylbutylamino)benzenesulfonamide
CID 103462650
2-[(4-ethylcyclohexyl)amino]-N-methylbenzenesulfonamide
CID 43749872
N-cyclopropyl-2-(2-hydroxypropylamino)benzenesulfonamide
CID 43500228
N-cyclopropyl-2-(2,3,3-trimethylbutylamino)benzenesulfonamide
CID 83142432
N-cyclopropyl-2-(pentylamino)benzenesulfonamide
CID 43454657
2-[(4-aminocyclohexyl)amino]benzenesulfonic acid
CID 54476877
2-[2-(cyclopropylsulfamoyl)anilino]propanoic acid
CID 43468799

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(cyclopropylamino)benzenesulfonamide?
The IUPAC name of N-cyclopropyl-2-(cyclopropylamino)benzenesulfonamide (CID 43454646) is N-cyclopropyl-2-(cyclopropylamino)benzenesulfonamide.
What is the SMILES notation for N-cyclopropyl-2-(cyclopropylamino)benzenesulfonamide?
The canonical SMILES for N-cyclopropyl-2-(cyclopropylamino)benzenesulfonamide is O=S(=O)(NC1CC1)c1ccccc1NC1CC1.
What is the InChIKey of N-cyclopropyl-2-(cyclopropylamino)benzenesulfonamide?
The InChIKey is HVWJFDJSZUTATB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2S/c15-17(16,14-10-7-8-10)12-4-2-1-3-11(12)13-9-5-6-9/h1-4,9-10,13-14H,5-8H2.
What are the key properties of N-cyclopropyl-2-(cyclopropylamino)benzenesulfonamide?
N-cyclopropyl-2-(cyclopropylamino)benzenesulfonamide has a molecular weight of 252.34 g/mol, XLogP of 1.70, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(cyclopropylamino)benzenesulfonamide is sourced from PubChem (CID 43454646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).