2-[[2-(morpholin-4-ylsulfonylamino)acetyl]amino]acetic acid

C8H15N3O6S — CID 43465613

IUPAC2-[[2-(morpholin-4-ylsulfonylamino)acetyl]amino]acetic acid
SMILESO=C(O)CNC(=O)CNS(=O)(=O)N1CCOCC1
InChIInChI=1S/C8H15N3O6S/c12-7(9-6-8(13)14)5-10-18(15,16)11-1-3-17-4-2-11/h10H,1-6H2,(H,9,12)(H,13,14)
InChIKeyNGIIGNDRFSEVCT-UHFFFAOYSA-N
MW281.29 g/mol
LogP-2.65
Rot. Bonds6

About 2-[[2-(morpholin-4-ylsulfonylamino)acetyl]amino]acetic acid

2-[[2-(morpholin-4-ylsulfonylamino)acetyl]amino]acetic acid (PubChem CID 43465613) has the molecular formula C8H15N3O6S and a molecular weight of 281.29 g/mol. Its IUPAC name is 2-[[2-(morpholin-4-ylsulfonylamino)acetyl]amino]acetic acid.

Molecular Properties

Compound Name2-[[2-(morpholin-4-ylsulfonylamino)acetyl]amino]acetic acid
PubChem CID43465613
Molecular FormulaC8H15N3O6S
Molecular Weight281.29 g/mol
Exact Mass281.07
IUPAC Name2-[[2-(morpholin-4-ylsulfonylamino)acetyl]amino]acetic acid
SMILESO=C(O)CNC(=O)CNS(=O)(=O)N1CCOCC1
InChIInChI=1S/C8H15N3O6S/c12-7(9-6-8(13)14)5-10-18(15,16)11-1-3-17-4-2-11/h10H,1-6H2,(H,9,12)(H,13,14)
InChIKeyNGIIGNDRFSEVCT-UHFFFAOYSA-N
XLogP-2.65
TPSA125.04 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.29
LogP ≤ 5-2.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

7-(morpholin-4-ylsulfonylamino)heptanoic acid
CID 28784453
2-(3-morpholin-4-ylpropanoylamino)acetic acid
CID 110834638
2-(morpholine-4-carbonylamino)acetic acid
CID 18917961
2-hydroxy-3-(morpholin-4-ylsulfonylamino)propanamide
CID 106169265
N-(3-iodopropyl)morpholine-4-sulfonamide
CID 114504667
2-[1-(morpholin-4-ylsulfonylamino)cyclohexyl]acetic acid
CID 64699977
2-[(3-morpholin-4-ylsulfonylbenzoyl)amino]acetic acid
CID 24691198
N-[(3-hydroxyoxolan-3-yl)methyl]morpholine-4-sulfonamide
CID 103848126
N-[2-(dimethylamino)ethyl]morpholine-4-sulfonamide
CID 110705984
(2S)-2-(morpholin-4-ylsulfonylamino)propanoic acid
CID 10354183
2-[4-(morpholin-4-ylsulfonylamino)phenoxy]acetic acid
CID 63770992
N-(2-hydroxy-2-phenylethyl)morpholine-4-sulfonamide
CID 43502480

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(morpholin-4-ylsulfonylamino)acetyl]amino]acetic acid?
The IUPAC name of 2-[[2-(morpholin-4-ylsulfonylamino)acetyl]amino]acetic acid (CID 43465613) is 2-[[2-(morpholin-4-ylsulfonylamino)acetyl]amino]acetic acid.
What is the SMILES notation for 2-[[2-(morpholin-4-ylsulfonylamino)acetyl]amino]acetic acid?
The canonical SMILES for 2-[[2-(morpholin-4-ylsulfonylamino)acetyl]amino]acetic acid is O=C(O)CNC(=O)CNS(=O)(=O)N1CCOCC1.
What is the InChIKey of 2-[[2-(morpholin-4-ylsulfonylamino)acetyl]amino]acetic acid?
The InChIKey is NGIIGNDRFSEVCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O6S/c12-7(9-6-8(13)14)5-10-18(15,16)11-1-3-17-4-2-11/h10H,1-6H2,(H,9,12)(H,13,14).
What are the key properties of 2-[[2-(morpholin-4-ylsulfonylamino)acetyl]amino]acetic acid?
2-[[2-(morpholin-4-ylsulfonylamino)acetyl]amino]acetic acid has a molecular weight of 281.29 g/mol, XLogP of -2.65, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(morpholin-4-ylsulfonylamino)acetyl]amino]acetic acid is sourced from PubChem (CID 43465613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).