2-amino-N-[(4-ethylmorpholin-2-yl)methyl]ethanesulfonamide

C9H21N3O3S — CID 114399731

IUPAC2-amino-N-[(4-ethylmorpholin-2-yl)methyl]ethanesulfonamide
SMILESCCN1CCOC(CNS(=O)(=O)CCN)C1
InChIInChI=1S/C9H21N3O3S/c1-2-12-4-5-15-9(8-12)7-11-16(13,14)6-3-10/h9,11H,2-8,10H2,1H3
InChIKeyFFLCHKGRZJSRCC-UHFFFAOYSA-N
MW251.35 g/mol
LogP-1.41
Rot. Bonds6

About 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]ethanesulfonamide

2-amino-N-[(4-ethylmorpholin-2-yl)methyl]ethanesulfonamide (PubChem CID 114399731) has the molecular formula C9H21N3O3S and a molecular weight of 251.35 g/mol. Its IUPAC name is 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]ethanesulfonamide.

Molecular Properties

Compound Name2-amino-N-[(4-ethylmorpholin-2-yl)methyl]ethanesulfonamide
PubChem CID114399731
Molecular FormulaC9H21N3O3S
Molecular Weight251.35 g/mol
Exact Mass251.13
IUPAC Name2-amino-N-[(4-ethylmorpholin-2-yl)methyl]ethanesulfonamide
SMILESCCN1CCOC(CNS(=O)(=O)CCN)C1
InChIInChI=1S/C9H21N3O3S/c1-2-12-4-5-15-9(8-12)7-11-16(13,14)6-3-10/h9,11H,2-8,10H2,1H3
InChIKeyFFLCHKGRZJSRCC-UHFFFAOYSA-N
XLogP-1.41
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.35
LogP ≤ 5-1.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(4-ethylmorpholin-2-yl)methylsulfamoyl]propanoic acid
CID 114399530
3-(ethylamino)-N-[(4-ethylmorpholin-2-yl)methyl]propane-1-sulfonamide
CID 106085709
N-[(4-ethylmorpholin-2-yl)methyl]piperazine-1-sulfonamide
CID 114400447
N-[(4-ethylmorpholin-2-yl)methyl]-1-piperidin-3-ylmethanesulfonamide
CID 114400701
1-cyano-N-[(4-ethylmorpholin-2-yl)methyl]propane-1-sulfonamide
CID 115766883
N-[(4-ethylmorpholin-2-yl)methyl]-1-ethylsulfonylpropan-2-amine
CID 115919948
N-[(4-methylmorpholin-2-yl)methyl]butane-1-sulfonamide
CID 110710241
3-amino-N-[(4-ethylmorpholin-2-yl)methyl]-4-hydroxybenzenesulfonamide
CID 114399093
2-tert-butylsulfonyl-N-[(4-ethylmorpholin-2-yl)methyl]ethanamine
CID 103710582
N-[(4-ethylmorpholin-2-yl)methyl]pyrrolidine-3-sulfonamide
CID 114401404
3-(aminomethyl)-N-[(4-ethylmorpholin-2-yl)methyl]-5-methyl-1H-pyrazole-4-sulfonamide
CID 106085721
3-amino-N-[(4-ethylmorpholin-2-yl)methyl]-5-fluorobenzenesulfonamide
CID 114399151

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]ethanesulfonamide?
The IUPAC name of 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]ethanesulfonamide (CID 114399731) is 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]ethanesulfonamide.
What is the SMILES notation for 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]ethanesulfonamide?
The canonical SMILES for 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]ethanesulfonamide is CCN1CCOC(CNS(=O)(=O)CCN)C1.
What is the InChIKey of 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]ethanesulfonamide?
The InChIKey is FFLCHKGRZJSRCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O3S/c1-2-12-4-5-15-9(8-12)7-11-16(13,14)6-3-10/h9,11H,2-8,10H2,1H3.
What are the key properties of 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]ethanesulfonamide?
2-amino-N-[(4-ethylmorpholin-2-yl)methyl]ethanesulfonamide has a molecular weight of 251.35 g/mol, XLogP of -1.41, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(4-ethylmorpholin-2-yl)methyl]ethanesulfonamide is sourced from PubChem (CID 114399731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).