N-methylazepane-1-sulfonamide

C7H16N2O2S — CID 28784575

IUPACN-methylazepane-1-sulfonamide
SMILESCNS(=O)(=O)N1CCCCCC1
InChIInChI=1S/C7H16N2O2S/c1-8-12(10,11)9-6-4-2-3-5-7-9/h8H,2-7H2,1H3
InChIKeyJRUIATMEJAZKCD-UHFFFAOYSA-N
MW192.28 g/mol
LogP0.33
Rot. Bonds2

About N-methylazepane-1-sulfonamide

N-methylazepane-1-sulfonamide (PubChem CID 28784575) has the molecular formula C7H16N2O2S and a molecular weight of 192.28 g/mol. Its IUPAC name is N-methylazepane-1-sulfonamide.

Molecular Properties

Compound NameN-methylazepane-1-sulfonamide
PubChem CID28784575
Molecular FormulaC7H16N2O2S
Molecular Weight192.28 g/mol
Exact Mass192.09
IUPAC NameN-methylazepane-1-sulfonamide
SMILESCNS(=O)(=O)N1CCCCCC1
InChIInChI=1S/C7H16N2O2S/c1-8-12(10,11)9-6-4-2-3-5-7-9/h8H,2-7H2,1H3
InChIKeyJRUIATMEJAZKCD-UHFFFAOYSA-N
XLogP0.33
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.28
LogP ≤ 50.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methylazocane-1-sulfonamide
CID 130686123
N-(methylaminomethyl)piperidine-1-sulfonamide
CID 117126231
N-methylpiperazine-1-sulfonamide;hydrochloride
CID 86812477
N-ethylazepane-1-sulfonamide
CID 43213421
N-but-3-yn-2-ylazepane-1-sulfonamide
CID 114419133
N-[4-(methylamino)cyclohexyl]piperidine-1-sulfonamide
CID 43653532
N-piperidin-1-ylsulfonylacetamide
CID 59405916
N-(2-cyanopropan-2-yl)azepane-1-sulfonamide
CID 61125739
N-[2-(methylamino)ethyl]pyrrolidine-1-sulfonamide
CID 62657611
methyl (3S)-1-(methylsulfamoyl)piperidine-3-carboxylate
CID 104978218
N-[2-(ethylamino)ethyl]azepane-1-sulfonamide
CID 62665481
N,2,6-trimethylmorpholine-4-sulfonamide
CID 43242358

Frequently Asked Questions

What is the IUPAC name of N-methylazepane-1-sulfonamide?
The IUPAC name of N-methylazepane-1-sulfonamide (CID 28784575) is N-methylazepane-1-sulfonamide.
What is the SMILES notation for N-methylazepane-1-sulfonamide?
The canonical SMILES for N-methylazepane-1-sulfonamide is CNS(=O)(=O)N1CCCCCC1.
What is the InChIKey of N-methylazepane-1-sulfonamide?
The InChIKey is JRUIATMEJAZKCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O2S/c1-8-12(10,11)9-6-4-2-3-5-7-9/h8H,2-7H2,1H3.
What are the key properties of N-methylazepane-1-sulfonamide?
N-methylazepane-1-sulfonamide has a molecular weight of 192.28 g/mol, XLogP of 0.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylazepane-1-sulfonamide is sourced from PubChem (CID 28784575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).