2-(1-aminoethyl)-N-cyclohexyl-N-methylmorpholine-4-sulfonamide

C13H27N3O3S — CID 115315403

IUPAC2-(1-aminoethyl)-N-cyclohexyl-N-methylmorpholine-4-sulfonamide
SMILESCC(N)C1CN(S(=O)(=O)N(C)C2CCCCC2)CCO1
InChIInChI=1S/C13H27N3O3S/c1-11(14)13-10-16(8-9-19-13)20(17,18)15(2)12-6-4-3-5-7-12/h11-13H,3-10,14H2,1-2H3
InChIKeyCBDRTIYALHEQMT-UHFFFAOYSA-N
MW305.44 g/mol
LogP0.54
Rot. Bonds4

About 2-(1-aminoethyl)-N-cyclohexyl-N-methylmorpholine-4-sulfonamide

2-(1-aminoethyl)-N-cyclohexyl-N-methylmorpholine-4-sulfonamide (PubChem CID 115315403) has the molecular formula C13H27N3O3S and a molecular weight of 305.44 g/mol. Its IUPAC name is 2-(1-aminoethyl)-N-cyclohexyl-N-methylmorpholine-4-sulfonamide.

Molecular Properties

Compound Name2-(1-aminoethyl)-N-cyclohexyl-N-methylmorpholine-4-sulfonamide
PubChem CID115315403
Molecular FormulaC13H27N3O3S
Molecular Weight305.44 g/mol
Exact Mass305.18
IUPAC Name2-(1-aminoethyl)-N-cyclohexyl-N-methylmorpholine-4-sulfonamide
SMILESCC(N)C1CN(S(=O)(=O)N(C)C2CCCCC2)CCO1
InChIInChI=1S/C13H27N3O3S/c1-11(14)13-10-16(8-9-19-13)20(17,18)15(2)12-6-4-3-5-7-12/h11-13H,3-10,14H2,1-2H3
InChIKeyCBDRTIYALHEQMT-UHFFFAOYSA-N
XLogP0.54
TPSA75.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.44
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-piperidin-1-ylsulfonylmorpholin-2-yl)ethanamine
CID 113285038
2-(1-aminoethyl)-N-cyclopropylmorpholine-4-sulfonamide
CID 114811287
2-[2-(1-aminoethyl)morpholin-4-yl]sulfonylpropanenitrile
CID 115315266
4-(2-aminopropanoyl)-N-cyclohexyl-N-methylpiperazine-1-sulfonamide
CID 119292580
1-[4-(2,6-dimethylmorpholin-4-yl)sulfonylmorpholin-2-yl]ethanamine
CID 115315408
3-(aminomethyl)-N-cyclohexyl-N-methylpyrrolidine-1-sulfonamide;hydrochloride
CID 119971798
1-(4-cyclohexylmorpholin-2-yl)ethanamine
CID 115315020
N-cyclohexyl-4-hydroxy-N,3-dimethylpiperidine-1-sulfonamide
CID 114680633
2-(1-aminoethyl)-N-(2-methylpropyl)morpholine-4-sulfonamide
CID 114816233
4-(4-aminopentanoyl)-N-cyclohexyl-N-methylpiperazine-1-sulfonamide;hydrochloride
CID 120560520
1-[cyclohexyl(methyl)sulfamoyl]pyrrolidine-3-carboxylic acid
CID 63030973
N-cyclohexyl-N,2-dimethylpiperidine-1-sulfonamide
CID 128926642

Frequently Asked Questions

What is the IUPAC name of 2-(1-aminoethyl)-N-cyclohexyl-N-methylmorpholine-4-sulfonamide?
The IUPAC name of 2-(1-aminoethyl)-N-cyclohexyl-N-methylmorpholine-4-sulfonamide (CID 115315403) is 2-(1-aminoethyl)-N-cyclohexyl-N-methylmorpholine-4-sulfonamide.
What is the SMILES notation for 2-(1-aminoethyl)-N-cyclohexyl-N-methylmorpholine-4-sulfonamide?
The canonical SMILES for 2-(1-aminoethyl)-N-cyclohexyl-N-methylmorpholine-4-sulfonamide is CC(N)C1CN(S(=O)(=O)N(C)C2CCCCC2)CCO1.
What is the InChIKey of 2-(1-aminoethyl)-N-cyclohexyl-N-methylmorpholine-4-sulfonamide?
The InChIKey is CBDRTIYALHEQMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O3S/c1-11(14)13-10-16(8-9-19-13)20(17,18)15(2)12-6-4-3-5-7-12/h11-13H,3-10,14H2,1-2H3.
What are the key properties of 2-(1-aminoethyl)-N-cyclohexyl-N-methylmorpholine-4-sulfonamide?
2-(1-aminoethyl)-N-cyclohexyl-N-methylmorpholine-4-sulfonamide has a molecular weight of 305.44 g/mol, XLogP of 0.54, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminoethyl)-N-cyclohexyl-N-methylmorpholine-4-sulfonamide is sourced from PubChem (CID 115315403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).