2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid

C10H15N3O4S — CID 104709662

IUPAC2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid
SMILESCn1nccc1S(=O)(=O)NC1CCCC1C(=O)O
InChIInChI=1S/C10H15N3O4S/c1-13-9(5-6-11-13)18(16,17)12-8-4-2-3-7(8)10(14)15/h5-8,12H,2-4H2,1H3,(H,14,15)
InChIKeyQLDPVMKODGDFQN-UHFFFAOYSA-N
MW273.31 g/mol
LogP-0.05
Rot. Bonds4

About 2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid

2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid (PubChem CID 104709662) has the molecular formula C10H15N3O4S and a molecular weight of 273.31 g/mol. Its IUPAC name is 2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid
PubChem CID104709662
Molecular FormulaC10H15N3O4S
Molecular Weight273.31 g/mol
Exact Mass273.08
IUPAC Name2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid
SMILESCn1nccc1S(=O)(=O)NC1CCCC1C(=O)O
InChIInChI=1S/C10H15N3O4S/c1-13-9(5-6-11-13)18(16,17)12-8-4-2-3-7(8)10(14)15/h5-8,12H,2-4H2,1H3,(H,14,15)
InChIKeyQLDPVMKODGDFQN-UHFFFAOYSA-N
XLogP-0.05
TPSA101.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid?
The IUPAC name of 2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid (CID 104709662) is 2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid is Cn1nccc1S(=O)(=O)NC1CCCC1C(=O)O.
What is the InChIKey of 2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid?
The InChIKey is QLDPVMKODGDFQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O4S/c1-13-9(5-6-11-13)18(16,17)12-8-4-2-3-7(8)10(14)15/h5-8,12H,2-4H2,1H3,(H,14,15).
What are the key properties of 2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid?
2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid has a molecular weight of 273.31 g/mol, XLogP of -0.05, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylpyrazol-3-yl)sulfonylamino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 104709662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).