1-cyclopentyl-4-methylpyrazine-2,3-dione

C10H14N2O2 — CID 134160439

IUPAC1-cyclopentyl-4-methylpyrazine-2,3-dione
SMILESCn1ccn(C2CCCC2)c(=O)c1=O
InChIInChI=1S/C10H14N2O2/c1-11-6-7-12(10(14)9(11)13)8-4-2-3-5-8/h6-8H,2-5H2,1H3
InChIKeyDZJIUNJHAQZXFI-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.66
Rot. Bonds1

About 1-cyclopentyl-4-methylpyrazine-2,3-dione

1-cyclopentyl-4-methylpyrazine-2,3-dione (PubChem CID 134160439) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 1-cyclopentyl-4-methylpyrazine-2,3-dione.

Molecular Properties

Compound Name1-cyclopentyl-4-methylpyrazine-2,3-dione
PubChem CID134160439
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name1-cyclopentyl-4-methylpyrazine-2,3-dione
SMILESCn1ccn(C2CCCC2)c(=O)c1=O
InChIInChI=1S/C10H14N2O2/c1-11-6-7-12(10(14)9(11)13)8-4-2-3-5-8/h6-8H,2-5H2,1H3
InChIKeyDZJIUNJHAQZXFI-UHFFFAOYSA-N
XLogP0.66
TPSA44.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1-cyclopentyl-4-methylpyrazine-2,3-dione 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

(1-cyclohexyl-3-methylimidazol-2-ylidene)platinum;cyclopropanamine
CID 157264535
4-cyclobutyl-1H-pyrazine-2,3-dione
CID 166103316
3-(chloromethyl)-1-cyclopentylpyridin-2-one
CID 82526593
1-cyclohexyl-3-methyl-2-sulfanylidenepyrimidin-4-one
CID 174629910
3-(aminomethyl)-1-cyclopentylpyridin-2-one
CID 82186493
5-bromo-1-cyclohexyl-3-methylpyrimidine-2,4-dione
CID 121223646
1-cyclohexyl-2-oxopyridine-3-carboxylic acid;hydrochloride
CID 70588854
3-cyclohexyl-1-methylpyrimidine-2,4-dione
CID 13290706
3-cyclopentyl-5,6-dimethylpyrimidin-4-one
CID 126857571
1-cyclopentyl-3-[(2-methylpropylamino)methyl]pyridin-2-one
CID 82526599
1-[2-cyclopentyl-2-(ethylamino)ethyl]-4-methylpyrazine-2,3-dione
CID 104747580
1-cyclopentylpyrrole-2,5-dione;2-methyloxaziridin-3-one
CID 18439097

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4-methylpyrazine-2,3-dione?
The IUPAC name of 1-cyclopentyl-4-methylpyrazine-2,3-dione (CID 134160439) is 1-cyclopentyl-4-methylpyrazine-2,3-dione.
What is the SMILES notation for 1-cyclopentyl-4-methylpyrazine-2,3-dione?
The canonical SMILES for 1-cyclopentyl-4-methylpyrazine-2,3-dione is Cn1ccn(C2CCCC2)c(=O)c1=O.
What is the InChIKey of 1-cyclopentyl-4-methylpyrazine-2,3-dione?
The InChIKey is DZJIUNJHAQZXFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-11-6-7-12(10(14)9(11)13)8-4-2-3-5-8/h6-8H,2-5H2,1H3.
What are the key properties of 1-cyclopentyl-4-methylpyrazine-2,3-dione?
1-cyclopentyl-4-methylpyrazine-2,3-dione has a molecular weight of 194.23 g/mol, XLogP of 0.66, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4-methylpyrazine-2,3-dione is sourced from PubChem (CID 134160439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).