1-(4-methoxy-6-methylpyrimidin-2-yl)pyrrolidine-2,5-dione

C10H11N3O3 — CID 135210799

IUPAC1-(4-methoxy-6-methylpyrimidin-2-yl)pyrrolidine-2,5-dione
SMILESCOc1cc(C)nc(N2C(=O)CCC2=O)n1
InChIInChI=1S/C10H11N3O3/c1-6-5-7(16-2)12-10(11-6)13-8(14)3-4-9(13)15/h5H,3-4H2,1-2H3
InChIKeyODDRVCCYRLUDDC-UHFFFAOYSA-N
MW221.22 g/mol
LogP0.45
Rot. Bonds2

About 1-(4-methoxy-6-methylpyrimidin-2-yl)pyrrolidine-2,5-dione

1-(4-methoxy-6-methylpyrimidin-2-yl)pyrrolidine-2,5-dione (PubChem CID 135210799) has the molecular formula C10H11N3O3 and a molecular weight of 221.22 g/mol. Its IUPAC name is 1-(4-methoxy-6-methylpyrimidin-2-yl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-(4-methoxy-6-methylpyrimidin-2-yl)pyrrolidine-2,5-dione
PubChem CID135210799
Molecular FormulaC10H11N3O3
Molecular Weight221.22 g/mol
Exact Mass221.08
IUPAC Name1-(4-methoxy-6-methylpyrimidin-2-yl)pyrrolidine-2,5-dione
SMILESCOc1cc(C)nc(N2C(=O)CCC2=O)n1
InChIInChI=1S/C10H11N3O3/c1-6-5-7(16-2)12-10(11-6)13-8(14)3-4-9(13)15/h5H,3-4H2,1-2H3
InChIKeyODDRVCCYRLUDDC-UHFFFAOYSA-N
XLogP0.45
TPSA72.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.22
LogP ≤ 50.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2,4-Dimethoxy-6-methylpyrimidine
CID 269820
N-(4-methoxy-6-methylpyrimidin-2-yl)-N-methylacetamide
CID 911086
4-Methoxy-2,6-dimethylpyrimidine
CID 12387338
N,N-diethyl-4-methoxy-6-methylpyrimidin-2-amine
CID 13789821
(2-methoxy-6-methylpyrimidin-4-yl) N,N-dimethylcarbamate
CID 76320254
Methyl 2-(4-methoxy-6-methylpyrimidin-2-yl)acetate
CID 12366559
2-Ethyl-4-methoxy-6-methylpyrimidine
CID 68086470
4-methoxy-6-methyl-N,N-dipropylpyrimidin-2-amine
CID 13789822
2-(4-methoxy-6-methylpyrimidin-2-yl)-5-methyl-4H-pyrazol-3-one
CID 131875358
(3S,4S)-1-(4-methoxy-6-methylpyrimidin-2-yl)-4-(trifluoromethyl)pyrrolidine-3-carboxamide
CID 120923324
[1-(4-Methoxy-6-methylpyrimidin-2-yl)-5-oxopyrrolidin-3-yl]methanesulfonyl fluoride
CID 168676156
1-(4-Methoxy-6-methylpyrimidin-2-yl)-5-oxopyrrolidine-3-sulfonyl fluoride
CID 168714560

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-6-methylpyrimidin-2-yl)pyrrolidine-2,5-dione?
The IUPAC name of 1-(4-methoxy-6-methylpyrimidin-2-yl)pyrrolidine-2,5-dione (CID 135210799) is 1-(4-methoxy-6-methylpyrimidin-2-yl)pyrrolidine-2,5-dione.
What is the SMILES notation for 1-(4-methoxy-6-methylpyrimidin-2-yl)pyrrolidine-2,5-dione?
The canonical SMILES for 1-(4-methoxy-6-methylpyrimidin-2-yl)pyrrolidine-2,5-dione is COc1cc(C)nc(N2C(=O)CCC2=O)n1.
What is the InChIKey of 1-(4-methoxy-6-methylpyrimidin-2-yl)pyrrolidine-2,5-dione?
The InChIKey is ODDRVCCYRLUDDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O3/c1-6-5-7(16-2)12-10(11-6)13-8(14)3-4-9(13)15/h5H,3-4H2,1-2H3.
What are the key properties of 1-(4-methoxy-6-methylpyrimidin-2-yl)pyrrolidine-2,5-dione?
1-(4-methoxy-6-methylpyrimidin-2-yl)pyrrolidine-2,5-dione has a molecular weight of 221.22 g/mol, XLogP of 0.45, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-6-methylpyrimidin-2-yl)pyrrolidine-2,5-dione is sourced from PubChem (CID 135210799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).