2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonylamino]cyclopentyl]acetic acid

C11H16N2O4S2 — CID 103414272

IUPAC2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonylamino]cyclopentyl]acetic acid
SMILESCc1ncc(S(=O)(=O)NC2(CC(=O)O)CCCC2)s1
InChIInChI=1S/C11H16N2O4S2/c1-8-12-7-10(18-8)19(16,17)13-11(6-9(14)15)4-2-3-5-11/h7,13H,2-6H2,1H3,(H,14,15)
InChIKeyFBPVHTLITGLUFY-UHFFFAOYSA-N
MW304.39 g/mol
LogP1.52
Rot. Bonds5

About 2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonylamino]cyclopentyl]acetic acid

2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonylamino]cyclopentyl]acetic acid (PubChem CID 103414272) has the molecular formula C11H16N2O4S2 and a molecular weight of 304.39 g/mol. Its IUPAC name is 2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonylamino]cyclopentyl]acetic acid.

Molecular Properties

Compound Name2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonylamino]cyclopentyl]acetic acid
PubChem CID103414272
Molecular FormulaC11H16N2O4S2
Molecular Weight304.39 g/mol
Exact Mass304.06
IUPAC Name2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonylamino]cyclopentyl]acetic acid
SMILESCc1ncc(S(=O)(=O)NC2(CC(=O)O)CCCC2)s1
InChIInChI=1S/C11H16N2O4S2/c1-8-12-7-10(18-8)19(16,17)13-11(6-9(14)15)4-2-3-5-11/h7,13H,2-6H2,1H3,(H,14,15)
InChIKeyFBPVHTLITGLUFY-UHFFFAOYSA-N
XLogP1.52
TPSA96.36 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonylamino]cyclopentyl]acetic acid?
The IUPAC name of 2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonylamino]cyclopentyl]acetic acid (CID 103414272) is 2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonylamino]cyclopentyl]acetic acid.
What is the SMILES notation for 2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonylamino]cyclopentyl]acetic acid?
The canonical SMILES for 2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonylamino]cyclopentyl]acetic acid is Cc1ncc(S(=O)(=O)NC2(CC(=O)O)CCCC2)s1.
What is the InChIKey of 2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonylamino]cyclopentyl]acetic acid?
The InChIKey is FBPVHTLITGLUFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O4S2/c1-8-12-7-10(18-8)19(16,17)13-11(6-9(14)15)4-2-3-5-11/h7,13H,2-6H2,1H3,(H,14,15).
What are the key properties of 2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonylamino]cyclopentyl]acetic acid?
2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonylamino]cyclopentyl]acetic acid has a molecular weight of 304.39 g/mol, XLogP of 1.52, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(2-methyl-1,3-thiazol-5-yl)sulfonylamino]cyclopentyl]acetic acid is sourced from PubChem (CID 103414272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).