2-[cyclopentyl-(1-methylpyrazol-4-yl)sulfonylamino]acetic acid

C11H17N3O4S — CID 60829977

IUPAC2-[cyclopentyl-(1-methylpyrazol-4-yl)sulfonylamino]acetic acid
SMILESCn1cc(S(=O)(=O)N(CC(=O)O)C2CCCC2)cn1
InChIInChI=1S/C11H17N3O4S/c1-13-7-10(6-12-13)19(17,18)14(8-11(15)16)9-4-2-3-5-9/h6-7,9H,2-5,8H2,1H3,(H,15,16)
InChIKeyMYYCEVYULSOKAR-UHFFFAOYSA-N
MW287.34 g/mol
LogP0.44
Rot. Bonds5

About 2-[cyclopentyl-(1-methylpyrazol-4-yl)sulfonylamino]acetic acid

2-[cyclopentyl-(1-methylpyrazol-4-yl)sulfonylamino]acetic acid (PubChem CID 60829977) has the molecular formula C11H17N3O4S and a molecular weight of 287.34 g/mol. Its IUPAC name is 2-[cyclopentyl-(1-methylpyrazol-4-yl)sulfonylamino]acetic acid.

Molecular Properties

Compound Name2-[cyclopentyl-(1-methylpyrazol-4-yl)sulfonylamino]acetic acid
PubChem CID60829977
Molecular FormulaC11H17N3O4S
Molecular Weight287.34 g/mol
Exact Mass287.09
IUPAC Name2-[cyclopentyl-(1-methylpyrazol-4-yl)sulfonylamino]acetic acid
SMILESCn1cc(S(=O)(=O)N(CC(=O)O)C2CCCC2)cn1
InChIInChI=1S/C11H17N3O4S/c1-13-7-10(6-12-13)19(17,18)14(8-11(15)16)9-4-2-3-5-9/h6-7,9H,2-5,8H2,1H3,(H,15,16)
InChIKeyMYYCEVYULSOKAR-UHFFFAOYSA-N
XLogP0.44
TPSA92.50 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[cyclopentyl-(1-methylpyrazol-4-yl)sulfonylamino]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-[methyl-(1-methylpyrazol-4-yl)sulfonylamino]acetic acid
CID 43361158
N-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-4-sulfonamide
CID 62062243
2-[cyclopentyl-(1,2-dimethylimidazol-4-yl)sulfonylamino]acetic acid
CID 62061909
N-(2-chloroethyl)-N-cyclopropyl-1-methylpyrazole-4-sulfonamide
CID 63397040
3-[4-[cyclopentyl(ethyl)sulfamoyl]pyrazol-1-yl]propanoic acid
CID 43541006
3-[cyclopropyl-(1-methylpyrazol-4-yl)sulfonylamino]propanethioamide
CID 62062104
2-[4-[cyclopentyl(2-hydroxyethyl)sulfamoyl]pyrazol-1-yl]acetic acid
CID 60950282
2-[cyclopentyl-(1-methylpyrazole-4-carbonyl)amino]acetic acid
CID 54926515
2-[4-[cycloheptyl(methyl)sulfamoyl]pyrazol-1-yl]acetic acid
CID 43613863
4-[methyl-(1-methylpyrazol-4-yl)sulfonylamino]butanoic acid
CID 43361582
2-[cyclopentyl-(3,4-difluorophenyl)sulfonylamino]acetic acid
CID 60828784
4-[ethyl-(1-methylpyrazol-4-yl)sulfonylamino]oxolane-3-carboxylic acid
CID 66247039

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl-(1-methylpyrazol-4-yl)sulfonylamino]acetic acid?
The IUPAC name of 2-[cyclopentyl-(1-methylpyrazol-4-yl)sulfonylamino]acetic acid (CID 60829977) is 2-[cyclopentyl-(1-methylpyrazol-4-yl)sulfonylamino]acetic acid.
What is the SMILES notation for 2-[cyclopentyl-(1-methylpyrazol-4-yl)sulfonylamino]acetic acid?
The canonical SMILES for 2-[cyclopentyl-(1-methylpyrazol-4-yl)sulfonylamino]acetic acid is Cn1cc(S(=O)(=O)N(CC(=O)O)C2CCCC2)cn1.
What is the InChIKey of 2-[cyclopentyl-(1-methylpyrazol-4-yl)sulfonylamino]acetic acid?
The InChIKey is MYYCEVYULSOKAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O4S/c1-13-7-10(6-12-13)19(17,18)14(8-11(15)16)9-4-2-3-5-9/h6-7,9H,2-5,8H2,1H3,(H,15,16).
What are the key properties of 2-[cyclopentyl-(1-methylpyrazol-4-yl)sulfonylamino]acetic acid?
2-[cyclopentyl-(1-methylpyrazol-4-yl)sulfonylamino]acetic acid has a molecular weight of 287.34 g/mol, XLogP of 0.44, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl-(1-methylpyrazol-4-yl)sulfonylamino]acetic acid is sourced from PubChem (CID 60829977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).