N-[1-(aminomethyl)cyclohexyl]morpholine-4-sulfonamide

C11H23N3O3S — CID 28940476

IUPACN-[1-(aminomethyl)cyclohexyl]morpholine-4-sulfonamide
SMILESNCC1(NS(=O)(=O)N2CCOCC2)CCCCC1
InChIInChI=1S/C11H23N3O3S/c12-10-11(4-2-1-3-5-11)13-18(15,16)14-6-8-17-9-7-14/h13H,1-10,12H2
InChIKeyHJTIWNCADLTOCW-UHFFFAOYSA-N
MW277.39 g/mol
LogP-0.19
Rot. Bonds4

About N-[1-(aminomethyl)cyclohexyl]morpholine-4-sulfonamide

N-[1-(aminomethyl)cyclohexyl]morpholine-4-sulfonamide (PubChem CID 28940476) has the molecular formula C11H23N3O3S and a molecular weight of 277.39 g/mol. Its IUPAC name is N-[1-(aminomethyl)cyclohexyl]morpholine-4-sulfonamide.

Molecular Properties

Compound NameN-[1-(aminomethyl)cyclohexyl]morpholine-4-sulfonamide
PubChem CID28940476
Molecular FormulaC11H23N3O3S
Molecular Weight277.39 g/mol
Exact Mass277.15
IUPAC NameN-[1-(aminomethyl)cyclohexyl]morpholine-4-sulfonamide
SMILESNCC1(NS(=O)(=O)N2CCOCC2)CCCCC1
InChIInChI=1S/C11H23N3O3S/c12-10-11(4-2-1-3-5-11)13-18(15,16)14-6-8-17-9-7-14/h13H,1-10,12H2
InChIKeyHJTIWNCADLTOCW-UHFFFAOYSA-N
XLogP-0.19
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
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-[1-(aminomethyl)cyclohexyl]morpholine-4-sulfonamide?
The IUPAC name of N-[1-(aminomethyl)cyclohexyl]morpholine-4-sulfonamide (CID 28940476) is N-[1-(aminomethyl)cyclohexyl]morpholine-4-sulfonamide.
What is the SMILES notation for N-[1-(aminomethyl)cyclohexyl]morpholine-4-sulfonamide?
The canonical SMILES for N-[1-(aminomethyl)cyclohexyl]morpholine-4-sulfonamide is NCC1(NS(=O)(=O)N2CCOCC2)CCCCC1.
What is the InChIKey of N-[1-(aminomethyl)cyclohexyl]morpholine-4-sulfonamide?
The InChIKey is HJTIWNCADLTOCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O3S/c12-10-11(4-2-1-3-5-11)13-18(15,16)14-6-8-17-9-7-14/h13H,1-10,12H2.
What are the key properties of N-[1-(aminomethyl)cyclohexyl]morpholine-4-sulfonamide?
N-[1-(aminomethyl)cyclohexyl]morpholine-4-sulfonamide has a molecular weight of 277.39 g/mol, XLogP of -0.19, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(aminomethyl)cyclohexyl]morpholine-4-sulfonamide is sourced from PubChem (CID 28940476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).