2-(cyclopentylsulfonylamino)-4-methoxybutanoic acid

C10H19NO5S — CID 105360794

IUPAC2-(cyclopentylsulfonylamino)-4-methoxybutanoic acid
SMILESCOCCC(NS(=O)(=O)C1CCCC1)C(=O)O
InChIInChI=1S/C10H19NO5S/c1-16-7-6-9(10(12)13)11-17(14,15)8-4-2-3-5-8/h8-9,11H,2-7H2,1H3,(H,12,13)
InChIKeySJZFGBAKMYTEAA-UHFFFAOYSA-N
MW265.33 g/mol
LogP0.34
Rot. Bonds7

About 2-(cyclopentylsulfonylamino)-4-methoxybutanoic acid

2-(cyclopentylsulfonylamino)-4-methoxybutanoic acid (PubChem CID 105360794) has the molecular formula C10H19NO5S and a molecular weight of 265.33 g/mol. Its IUPAC name is 2-(cyclopentylsulfonylamino)-4-methoxybutanoic acid.

Molecular Properties

Compound Name2-(cyclopentylsulfonylamino)-4-methoxybutanoic acid
PubChem CID105360794
Molecular FormulaC10H19NO5S
Molecular Weight265.33 g/mol
Exact Mass265.10
IUPAC Name2-(cyclopentylsulfonylamino)-4-methoxybutanoic acid
SMILESCOCCC(NS(=O)(=O)C1CCCC1)C(=O)O
InChIInChI=1S/C10H19NO5S/c1-16-7-6-9(10(12)13)11-17(14,15)8-4-2-3-5-8/h8-9,11H,2-7H2,1H3,(H,12,13)
InChIKeySJZFGBAKMYTEAA-UHFFFAOYSA-N
XLogP0.34
TPSA92.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-(cyclopentylsulfonylamino)-5-methoxy-5-oxopentanoic acid
CID 114005100
(2S)-2-(cyclohexylsulfonylamino)-5-methoxy-5-oxopentanoic acid
CID 107823923
2-(cyclopentylsulfonylamino)-3-hydroxypropanoic acid
CID 105360687
2-(cyclopropylsulfamoylamino)-4-methoxybutanoic acid
CID 114533415
2-(cyclohexylsulfonylamino)-4-methylpentanoic acid
CID 61065990
(2S)-2-(cyclohexylsulfonylamino)-4-methylpentanoic acid
CID 61155518
2-[(1,1-dioxothiolan-3-yl)sulfonylamino]-5-methoxypentanoic acid
CID 81078936
(2S)-2-(cyclopropylsulfonylamino)-4-methoxy-4-oxobutanoic acid
CID 64553878
2-(cycloheptanecarbonylamino)-4-methoxybutanoic acid
CID 55091388
(2R)-2-(cyclopentylsulfonylamino)propanoic acid
CID 105360780
(2R)-2-(cyclopropylsulfonylamino)-4-methylpentanoic acid
CID 78996641
4-methoxy-2-[(3-methoxy-3-oxopropyl)sulfonylamino]butanoic acid
CID 62480752

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylsulfonylamino)-4-methoxybutanoic acid?
The IUPAC name of 2-(cyclopentylsulfonylamino)-4-methoxybutanoic acid (CID 105360794) is 2-(cyclopentylsulfonylamino)-4-methoxybutanoic acid.
What is the SMILES notation for 2-(cyclopentylsulfonylamino)-4-methoxybutanoic acid?
The canonical SMILES for 2-(cyclopentylsulfonylamino)-4-methoxybutanoic acid is COCCC(NS(=O)(=O)C1CCCC1)C(=O)O.
What is the InChIKey of 2-(cyclopentylsulfonylamino)-4-methoxybutanoic acid?
The InChIKey is SJZFGBAKMYTEAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO5S/c1-16-7-6-9(10(12)13)11-17(14,15)8-4-2-3-5-8/h8-9,11H,2-7H2,1H3,(H,12,13).
What are the key properties of 2-(cyclopentylsulfonylamino)-4-methoxybutanoic acid?
2-(cyclopentylsulfonylamino)-4-methoxybutanoic acid has a molecular weight of 265.33 g/mol, XLogP of 0.34, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylsulfonylamino)-4-methoxybutanoic acid is sourced from PubChem (CID 105360794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).