1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one

C10H13N3O — CID 166608936

IUPAC1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one
SMILESCc1cc(C)nc(N2CCCC2=O)n1
InChIInChI=1S/C10H13N3O/c1-7-6-8(2)12-10(11-7)13-5-3-4-9(13)14/h6H,3-5H2,1-2H3
InChIKeyUCRLOPCWLMBXGH-UHFFFAOYSA-N
MW191.23 g/mol
LogP1.22
Rot. Bonds1

About 1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one

1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one (PubChem CID 166608936) has the molecular formula C10H13N3O and a molecular weight of 191.23 g/mol. Its IUPAC name is 1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one
PubChem CID166608936
Molecular FormulaC10H13N3O
Molecular Weight191.23 g/mol
Exact Mass191.11
IUPAC Name1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one
SMILESCc1cc(C)nc(N2CCCC2=O)n1
InChIInChI=1S/C10H13N3O/c1-7-6-8(2)12-10(11-7)13-5-3-4-9(13)14/h6H,3-5H2,1-2H3
InChIKeyUCRLOPCWLMBXGH-UHFFFAOYSA-N
XLogP1.22
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.23
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[4-[[[1-(4,6-dimethylpyrimidin-2-yl)piperidin-4-yl]amino]methyl]phenyl]pyrrolidin-2-one
CID 72903842
1-(3,5-dimethylphenyl)pyrrolidin-2-one
CID 847897
ethane;1-(6-methyl-2-pyridinyl)pyrrolidin-2-one
CID 142348344
1-(2-methyl-4-pyridinyl)pyrrolidin-2-one
CID 70517179
4-chloro-1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one
CID 168688388
1,4-bis(4,6-dimethylpyrimidin-2-yl)-1,4-diazepane
CID 99786904
1-(6-bromo-3-methyl-2-pyridinyl)pyrrolidin-2-one
CID 177346413
2,6-dimethyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonyl chloride
CID 16642641
1-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidin-2-one
CID 822790
ethane;1-(4-methylphenyl)pyrrolidin-2-one
CID 143607645
1-(5-ethyl-6-methyl-2-pyridinyl)pyrrolidin-2-one
CID 166909775
1-(5-amino-2,3-dimethylphenyl)pyrrolidin-2-one
CID 13062320

Frequently Asked Questions

What is the IUPAC name of 1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one?
The IUPAC name of 1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one (CID 166608936) is 1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one.
What is the SMILES notation for 1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one?
The canonical SMILES for 1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one is Cc1cc(C)nc(N2CCCC2=O)n1.
What is the InChIKey of 1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one?
The InChIKey is UCRLOPCWLMBXGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O/c1-7-6-8(2)12-10(11-7)13-5-3-4-9(13)14/h6H,3-5H2,1-2H3.
What are the key properties of 1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one?
1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one has a molecular weight of 191.23 g/mol, XLogP of 1.22, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one is sourced from PubChem (CID 166608936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).