N-(2-aminocycloheptyl)morpholine-4-sulfonamide

C11H23N3O3S — CID 63258708

IUPACN-(2-aminocycloheptyl)morpholine-4-sulfonamide
SMILESNC1CCCCCC1NS(=O)(=O)N1CCOCC1
InChIInChI=1S/C11H23N3O3S/c12-10-4-2-1-3-5-11(10)13-18(15,16)14-6-8-17-9-7-14/h10-11,13H,1-9,12H2
InChIKeyZMGAFLXQKSIIGX-UHFFFAOYSA-N
MW277.39 g/mol
LogP-0.19
Rot. Bonds3

About N-(2-aminocycloheptyl)morpholine-4-sulfonamide

N-(2-aminocycloheptyl)morpholine-4-sulfonamide (PubChem CID 63258708) has the molecular formula C11H23N3O3S and a molecular weight of 277.39 g/mol. Its IUPAC name is N-(2-aminocycloheptyl)morpholine-4-sulfonamide.

Molecular Properties

Compound NameN-(2-aminocycloheptyl)morpholine-4-sulfonamide
PubChem CID63258708
Molecular FormulaC11H23N3O3S
Molecular Weight277.39 g/mol
Exact Mass277.15
IUPAC NameN-(2-aminocycloheptyl)morpholine-4-sulfonamide
SMILESNC1CCCCCC1NS(=O)(=O)N1CCOCC1
InChIInChI=1S/C11H23N3O3S/c12-10-4-2-1-3-5-11(10)13-18(15,16)14-6-8-17-9-7-14/h10-11,13H,1-9,12H2
InChIKeyZMGAFLXQKSIIGX-UHFFFAOYSA-N
XLogP-0.19
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 5-0.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-aminocycloheptyl)morpholine-4-sulfonamide?
The IUPAC name of N-(2-aminocycloheptyl)morpholine-4-sulfonamide (CID 63258708) is N-(2-aminocycloheptyl)morpholine-4-sulfonamide.
What is the SMILES notation for N-(2-aminocycloheptyl)morpholine-4-sulfonamide?
The canonical SMILES for N-(2-aminocycloheptyl)morpholine-4-sulfonamide is NC1CCCCCC1NS(=O)(=O)N1CCOCC1.
What is the InChIKey of N-(2-aminocycloheptyl)morpholine-4-sulfonamide?
The InChIKey is ZMGAFLXQKSIIGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O3S/c12-10-4-2-1-3-5-11(10)13-18(15,16)14-6-8-17-9-7-14/h10-11,13H,1-9,12H2.
What are the key properties of N-(2-aminocycloheptyl)morpholine-4-sulfonamide?
N-(2-aminocycloheptyl)morpholine-4-sulfonamide has a molecular weight of 277.39 g/mol, XLogP of -0.19, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocycloheptyl)morpholine-4-sulfonamide is sourced from PubChem (CID 63258708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).