2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentyl]acetic acid

C12H19N3O4S — CID 64673316

IUPAC2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentyl]acetic acid
SMILESCc1n[nH]c(C)c1S(=O)(=O)NC1(CC(=O)O)CCCC1
InChIInChI=1S/C12H19N3O4S/c1-8-11(9(2)14-13-8)20(18,19)15-12(7-10(16)17)5-3-4-6-12/h15H,3-7H2,1-2H3,(H,13,14)(H,16,17)
InChIKeyTXXVDTVFEZUTQF-UHFFFAOYSA-N
MW301.37 g/mol
LogP1.09
Rot. Bonds5

About 2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentyl]acetic acid

2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentyl]acetic acid (PubChem CID 64673316) has the molecular formula C12H19N3O4S and a molecular weight of 301.37 g/mol. Its IUPAC name is 2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentyl]acetic acid.

Molecular Properties

Compound Name2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentyl]acetic acid
PubChem CID64673316
Molecular FormulaC12H19N3O4S
Molecular Weight301.37 g/mol
Exact Mass301.11
IUPAC Name2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentyl]acetic acid
SMILESCc1n[nH]c(C)c1S(=O)(=O)NC1(CC(=O)O)CCCC1
InChIInChI=1S/C12H19N3O4S/c1-8-11(9(2)14-13-8)20(18,19)15-12(7-10(16)17)5-3-4-6-12/h15H,3-7H2,1-2H3,(H,13,14)(H,16,17)
InChIKeyTXXVDTVFEZUTQF-UHFFFAOYSA-N
XLogP1.09
TPSA112.15 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.37
LogP ≤ 51.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentyl]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

N-[(1-hydroxycycloheptyl)methyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 65122316
1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cycloheptane-1-carbothioamide
CID 61122478
2-[1-[(2-chloro-6-methylphenyl)sulfonylamino]cyclobutyl]acetic acid
CID 166283600
2-[1-[(1,2-dimethylimidazol-4-yl)sulfonylamino]cyclopentyl]acetic acid
CID 64671759
2-[1-(dimethylsulfamoylamino)cyclohexyl]acetic acid
CID 64700173
3,5-dimethyl-N-(4-methylpiperidin-4-yl)-1H-pyrazole-4-sulfonamide
CID 114696800
2-[1-[(2,4,6-trichlorophenyl)sulfonylamino]cyclobutyl]acetic acid
CID 79844855
2-[1-[(1,2-dimethylimidazol-4-yl)sulfonylamino]cyclohexyl]acetic acid
CID 64702323
3-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]-2,2-dimethylpropanoic acid
CID 115427468
(2S)-2-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]pentanedioic acid
CID 61145220
2-[1-(sulfamoylamino)cyclohexyl]acetic acid
CID 114958917
2-[1-[(2-ethyl-1H-imidazol-5-yl)sulfonylamino]cyclobutyl]acetic acid
CID 79845600

Frequently Asked Questions

What is the IUPAC name of 2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentyl]acetic acid?
The IUPAC name of 2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentyl]acetic acid (CID 64673316) is 2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentyl]acetic acid.
What is the SMILES notation for 2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentyl]acetic acid?
The canonical SMILES for 2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentyl]acetic acid is Cc1n[nH]c(C)c1S(=O)(=O)NC1(CC(=O)O)CCCC1.
What is the InChIKey of 2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentyl]acetic acid?
The InChIKey is TXXVDTVFEZUTQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O4S/c1-8-11(9(2)14-13-8)20(18,19)15-12(7-10(16)17)5-3-4-6-12/h15H,3-7H2,1-2H3,(H,13,14)(H,16,17).
What are the key properties of 2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentyl]acetic acid?
2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentyl]acetic acid has a molecular weight of 301.37 g/mol, XLogP of 1.09, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonylamino]cyclopentyl]acetic acid is sourced from PubChem (CID 64673316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).