N-(3-amino-2,2-difluoropropyl)cyclohexanesulfonamide

C9H18F2N2O2S — CID 114383985

IUPACN-(3-amino-2,2-difluoropropyl)cyclohexanesulfonamide
SMILESNCC(F)(F)CNS(=O)(=O)C1CCCCC1
InChIInChI=1S/C9H18F2N2O2S/c10-9(11,6-12)7-13-16(14,15)8-4-2-1-3-5-8/h8,13H,1-7,12H2
InChIKeyGHOFPFRNGDDNEA-UHFFFAOYSA-N
MW256.32 g/mol
LogP0.83
Rot. Bonds5

About N-(3-amino-2,2-difluoropropyl)cyclohexanesulfonamide

N-(3-amino-2,2-difluoropropyl)cyclohexanesulfonamide (PubChem CID 114383985) has the molecular formula C9H18F2N2O2S and a molecular weight of 256.32 g/mol. Its IUPAC name is N-(3-amino-2,2-difluoropropyl)cyclohexanesulfonamide.

Molecular Properties

Compound NameN-(3-amino-2,2-difluoropropyl)cyclohexanesulfonamide
PubChem CID114383985
Molecular FormulaC9H18F2N2O2S
Molecular Weight256.32 g/mol
Exact Mass256.11
IUPAC NameN-(3-amino-2,2-difluoropropyl)cyclohexanesulfonamide
SMILESNCC(F)(F)CNS(=O)(=O)C1CCCCC1
InChIInChI=1S/C9H18F2N2O2S/c10-9(11,6-12)7-13-16(14,15)8-4-2-1-3-5-8/h8,13H,1-7,12H2
InChIKeyGHOFPFRNGDDNEA-UHFFFAOYSA-N
XLogP0.83
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.32
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-amino-2,2-dimethylpropyl)cyclobutanesulfonamide
CID 115270992
3-(cyclohexylsulfonylamino)-2,2-dimethylpropanoic acid
CID 115427537
N-(3-chloro-2,2-dimethylpropyl)cyclohexanesulfonamide
CID 115365303
N-(3,3,3-trifluoro-2-hydroxypropyl)cyclohexanesulfonamide
CID 113242615
N-(3-aminopropyl)cyclopentanesulfonamide
CID 115752131
N-(4-bromo-2,2-dimethylbutyl)cyclohexanesulfonamide
CID 106145688
N-(6-aminohexyl)cyclohexanesulfonamide
CID 114008140
N-[2,2-dimethyl-3-(methylamino)propyl]cyclopentanesulfonamide
CID 115271131
N-(4-aminobutyl)cyclopentanesulfonamide
CID 105360505
2-(cyclohexylsulfonylamino)acetamide
CID 64591564
N-(4-hydroxybutyl)cyclohexanesulfonamide
CID 106843941
N-(3-amino-2,2-dimethylpropyl)-1-methylpiperidine-4-sulfonamide
CID 115270989

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,2-difluoropropyl)cyclohexanesulfonamide?
The IUPAC name of N-(3-amino-2,2-difluoropropyl)cyclohexanesulfonamide (CID 114383985) is N-(3-amino-2,2-difluoropropyl)cyclohexanesulfonamide.
What is the SMILES notation for N-(3-amino-2,2-difluoropropyl)cyclohexanesulfonamide?
The canonical SMILES for N-(3-amino-2,2-difluoropropyl)cyclohexanesulfonamide is NCC(F)(F)CNS(=O)(=O)C1CCCCC1.
What is the InChIKey of N-(3-amino-2,2-difluoropropyl)cyclohexanesulfonamide?
The InChIKey is GHOFPFRNGDDNEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18F2N2O2S/c10-9(11,6-12)7-13-16(14,15)8-4-2-1-3-5-8/h8,13H,1-7,12H2.
What are the key properties of N-(3-amino-2,2-difluoropropyl)cyclohexanesulfonamide?
N-(3-amino-2,2-difluoropropyl)cyclohexanesulfonamide has a molecular weight of 256.32 g/mol, XLogP of 0.83, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,2-difluoropropyl)cyclohexanesulfonamide is sourced from PubChem (CID 114383985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).