2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid

C10H20N2O5S — CID 62033516

IUPAC2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid
SMILESCC(C)CN(CC(=O)O)S(=O)(=O)N1CCOCC1
InChIInChI=1S/C10H20N2O5S/c1-9(2)7-12(8-10(13)14)18(15,16)11-3-5-17-6-4-11/h9H,3-8H2,1-2H3,(H,13,14)
InChIKeyHANCWHZPYYQGDR-UHFFFAOYSA-N
MW280.35 g/mol
LogP-0.39
Rot. Bonds6

About 2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid

2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid (PubChem CID 62033516) has the molecular formula C10H20N2O5S and a molecular weight of 280.35 g/mol. Its IUPAC name is 2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid.

Molecular Properties

Compound Name2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid
PubChem CID62033516
Molecular FormulaC10H20N2O5S
Molecular Weight280.35 g/mol
Exact Mass280.11
IUPAC Name2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid
SMILESCC(C)CN(CC(=O)O)S(=O)(=O)N1CCOCC1
InChIInChI=1S/C10H20N2O5S/c1-9(2)7-12(8-10(13)14)18(15,16)11-3-5-17-6-4-11/h9H,3-8H2,1-2H3,(H,13,14)
InChIKeyHANCWHZPYYQGDR-UHFFFAOYSA-N
XLogP-0.39
TPSA87.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.35
LogP ≤ 5-0.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(3-methylpiperidin-1-yl)sulfonyl-(2-methylpropyl)amino]acetic acid
CID 63066424
N,N-bis(3-methylbutyl)-4-(2-morpholin-4-ylacetyl)piperazine-1-sulfonamide
CID 55988894
2-[cyclopropylsulfonyl(2-methylpropyl)amino]acetic acid
CID 64552825
2-[cyclopentyl(morpholin-4-ylsulfonyl)amino]acetic acid
CID 54925872
N-(2-hydroxyethyl)-N-propan-2-ylmorpholine-4-sulfonamide
CID 43574633
ethyl 2-[morpholin-4-ylsulfonyl(propan-2-yl)amino]acetate
CID 51087618
2-[azetidin-1-ylsulfonyl(propyl)amino]acetic acid
CID 122071260
4-morpholin-4-ylsulfonyl-N,N-dipropylpiperazine-1-sulfonamide
CID 55627166
N-butyl-N-(2-chloroethyl)morpholine-4-sulfonamide
CID 63396894
2-[3-methylbutylsulfonyl(2-methylpropyl)amino]acetic acid
CID 63856773
2-[tert-butylsulfonyl(2-methylpropyl)amino]acetic acid
CID 63689160
2-[2-methylpropyl(trifluoromethylsulfonyl)amino]acetic acid
CID 63066774

Frequently Asked Questions

What is the IUPAC name of 2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid?
The IUPAC name of 2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid (CID 62033516) is 2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid.
What is the SMILES notation for 2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid?
The canonical SMILES for 2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid is CC(C)CN(CC(=O)O)S(=O)(=O)N1CCOCC1.
What is the InChIKey of 2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid?
The InChIKey is HANCWHZPYYQGDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O5S/c1-9(2)7-12(8-10(13)14)18(15,16)11-3-5-17-6-4-11/h9H,3-8H2,1-2H3,(H,13,14).
What are the key properties of 2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid?
2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid has a molecular weight of 280.35 g/mol, XLogP of -0.39, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methylpropyl(morpholin-4-ylsulfonyl)amino]acetic acid is sourced from PubChem (CID 62033516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).