4-[2-(2-methylpyrimidin-4-yl)imidazol-1-yl]-1-propylpyrrolidin-2-one

C15H19N5O — CID 154563511

IUPAC4-[2-(2-methylpyrimidin-4-yl)imidazol-1-yl]-1-propylpyrrolidin-2-one
SMILESCCCN1CC(n2ccnc2-c2ccnc(C)n2)CC1=O
InChIInChI=1S/C15H19N5O/c1-3-7-19-10-12(9-14(19)21)20-8-6-17-15(20)13-4-5-16-11(2)18-13/h4-6,8,12H,3,7,9-10H2,1-2H3
InChIKeyYZOMFEIKQOTTPZ-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.83
Rot. Bonds4

About 4-[2-(2-methylpyrimidin-4-yl)imidazol-1-yl]-1-propylpyrrolidin-2-one

4-[2-(2-methylpyrimidin-4-yl)imidazol-1-yl]-1-propylpyrrolidin-2-one (PubChem CID 154563511) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is 4-[2-(2-methylpyrimidin-4-yl)imidazol-1-yl]-1-propylpyrrolidin-2-one.

Molecular Properties

Compound Name4-[2-(2-methylpyrimidin-4-yl)imidazol-1-yl]-1-propylpyrrolidin-2-one
PubChem CID154563511
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name4-[2-(2-methylpyrimidin-4-yl)imidazol-1-yl]-1-propylpyrrolidin-2-one
SMILESCCCN1CC(n2ccnc2-c2ccnc(C)n2)CC1=O
InChIInChI=1S/C15H19N5O/c1-3-7-19-10-12(9-14(19)21)20-8-6-17-15(20)13-4-5-16-11(2)18-13/h4-6,8,12H,3,7,9-10H2,1-2H3
InChIKeyYZOMFEIKQOTTPZ-UHFFFAOYSA-N
XLogP1.83
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-[2-(5-fluoro-2-pyrazol-1-ylphenyl)imidazol-1-yl]-1-propylpyrrolidin-2-one
CID 146042252
acetic acid;4-[2-[3-(3,5-dimethylpyrazol-1-yl)phenyl]imidazol-1-yl]-1-propylpyrrolidin-2-one
CID 155971822
(4S)-4-[2-(1-methylimidazol-2-yl)imidazol-1-yl]-1-propan-2-ylpyrrolidin-2-one
CID 96581489
(4S)-1-propyl-4-[(4-pyridin-3-ylpyrimidin-2-yl)amino]pyrrolidin-2-one
CID 97444975
(4R)-1-ethyl-4-[5-(2-ethylpyrimidin-4-yl)-4-phenylimidazol-1-yl]pyrrolidin-2-one
CID 95120380
1-(3-chlorophenyl)-4-[2-(1-methylimidazol-2-yl)imidazol-1-yl]pyrrolidin-2-one
CID 154568444
(3S)-5-oxo-1-propylpyrrolidine-3-carboxylic acid
CID 7583712
(4R)-4-[2-(4-phenyl-1,3-thiazol-2-yl)imidazol-1-yl]-1-propan-2-ylpyrrolidin-2-one
CID 97042055
4-phenyl-1-propylpyrrolidin-2-one
CID 13362249
4-[4-[2-(4-methylphenoxy)acetyl]piperazine-1-carbonyl]-1-propylpyrrolidin-2-one
CID 110346269
4-amino-1-tert-butyl-5-(2-methylpyrimidin-4-yl)pyrrolidin-2-one
CID 113329240
1-(2,3-dihydro-1H-inden-2-yl)-2-(1-methylpyrazol-3-yl)imidazole
CID 155910429

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-methylpyrimidin-4-yl)imidazol-1-yl]-1-propylpyrrolidin-2-one?
The IUPAC name of 4-[2-(2-methylpyrimidin-4-yl)imidazol-1-yl]-1-propylpyrrolidin-2-one (CID 154563511) is 4-[2-(2-methylpyrimidin-4-yl)imidazol-1-yl]-1-propylpyrrolidin-2-one.
What is the SMILES notation for 4-[2-(2-methylpyrimidin-4-yl)imidazol-1-yl]-1-propylpyrrolidin-2-one?
The canonical SMILES for 4-[2-(2-methylpyrimidin-4-yl)imidazol-1-yl]-1-propylpyrrolidin-2-one is CCCN1CC(n2ccnc2-c2ccnc(C)n2)CC1=O.
What is the InChIKey of 4-[2-(2-methylpyrimidin-4-yl)imidazol-1-yl]-1-propylpyrrolidin-2-one?
The InChIKey is YZOMFEIKQOTTPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-3-7-19-10-12(9-14(19)21)20-8-6-17-15(20)13-4-5-16-11(2)18-13/h4-6,8,12H,3,7,9-10H2,1-2H3.
What are the key properties of 4-[2-(2-methylpyrimidin-4-yl)imidazol-1-yl]-1-propylpyrrolidin-2-one?
4-[2-(2-methylpyrimidin-4-yl)imidazol-1-yl]-1-propylpyrrolidin-2-one has a molecular weight of 285.35 g/mol, XLogP of 1.83, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-methylpyrimidin-4-yl)imidazol-1-yl]-1-propylpyrrolidin-2-one is sourced from PubChem (CID 154563511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).