3-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]pyrrolidine-2,5-dione

C9H12N4O2 — CID 43637914

IUPAC3-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]pyrrolidine-2,5-dione
SMILESCc1n[nH]c(C)c1NC1CC(=O)NC1=O
InChIInChI=1S/C9H12N4O2/c1-4-8(5(2)13-12-4)10-6-3-7(14)11-9(6)15/h6,10H,3H2,1-2H3,(H,12,13)(H,11,14,15)
InChIKeySUGIIYCWMRRNCA-UHFFFAOYSA-N
MW208.22 g/mol
LogP-0.15
Rot. Bonds2

About 3-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]pyrrolidine-2,5-dione

3-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]pyrrolidine-2,5-dione (PubChem CID 43637914) has the molecular formula C9H12N4O2 and a molecular weight of 208.22 g/mol. Its IUPAC name is 3-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]pyrrolidine-2,5-dione.

Molecular Properties

Compound Name3-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]pyrrolidine-2,5-dione
PubChem CID43637914
Molecular FormulaC9H12N4O2
Molecular Weight208.22 g/mol
Exact Mass208.10
IUPAC Name3-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]pyrrolidine-2,5-dione
SMILESCc1n[nH]c(C)c1NC1CC(=O)NC1=O
InChIInChI=1S/C9H12N4O2/c1-4-8(5(2)13-12-4)10-6-3-7(14)11-9(6)15/h6,10H,3H2,1-2H3,(H,12,13)(H,11,14,15)
InChIKeySUGIIYCWMRRNCA-UHFFFAOYSA-N
XLogP-0.15
TPSA86.88 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.22
LogP ≤ 5-0.15
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 3-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]pyrrolidine-2,5-dione with MolForge

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Related Compounds

(3S)-3-(methylamino)pyrrolidine-2,5-dione
CID 98340872
3-(2,6-dibromoanilino)pyrrolidine-2,5-dione
CID 107598662
N-(2-adamantyl)-3,5-dimethyl-1H-pyrazol-4-amine
CID 43621714
3-(hydroxyamino)pyrrolidine-2,5-dione
CID 22569755
N-(1,1-dioxothiolan-3-yl)-3,5-dimethyl-1H-pyrazol-4-amine
CID 43547628
3-[(4-ethyl-5-methyl-1,3-thiazol-2-yl)amino]pyrrolidine-2,5-dione
CID 61473288
3-[(6-methoxy-3-pyridinyl)amino]pyrrolidine-2,5-dione
CID 43637684
3,5-dimethyl-N-(2-methylsulfonylcyclopentyl)-1H-pyrazol-4-amine
CID 65044159
N-(2-bicyclo[3.1.0]hexanyl)-3,5-dimethyl-1H-pyrazol-4-amine
CID 130525381
N-(5,5-dimethylthian-3-yl)-3,5-dimethyl-1H-pyrazol-4-amine
CID 79956145
N-(2,5-dimethylcyclohexyl)-3,5-dimethyl-1H-pyrazol-4-amine
CID 64761189
N,3,5-trimethyl-1H-pyrazol-4-amine;hydrochloride
CID 56773738

Frequently Asked Questions

What is the IUPAC name of 3-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]pyrrolidine-2,5-dione?
The IUPAC name of 3-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]pyrrolidine-2,5-dione (CID 43637914) is 3-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]pyrrolidine-2,5-dione.
What is the SMILES notation for 3-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]pyrrolidine-2,5-dione?
The canonical SMILES for 3-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]pyrrolidine-2,5-dione is Cc1n[nH]c(C)c1NC1CC(=O)NC1=O.
What is the InChIKey of 3-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]pyrrolidine-2,5-dione?
The InChIKey is SUGIIYCWMRRNCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O2/c1-4-8(5(2)13-12-4)10-6-3-7(14)11-9(6)15/h6,10H,3H2,1-2H3,(H,12,13)(H,11,14,15).
What are the key properties of 3-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]pyrrolidine-2,5-dione?
3-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]pyrrolidine-2,5-dione has a molecular weight of 208.22 g/mol, XLogP of -0.15, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3,5-dimethyl-1H-pyrazol-4-yl)amino]pyrrolidine-2,5-dione is sourced from PubChem (CID 43637914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).