3-[2-(6-methyl-3-pyridinyl)imidazol-1-yl]pyrrolidin-2-one

C13H14N4O — CID 155914038

IUPAC3-[2-(6-methyl-3-pyridinyl)imidazol-1-yl]pyrrolidin-2-one
SMILESCc1ccc(-c2nccn2C2CCNC2=O)cn1
InChIInChI=1S/C13H14N4O/c1-9-2-3-10(8-16-9)12-14-6-7-17(12)11-4-5-15-13(11)18/h2-3,6-8,11H,4-5H2,1H3,(H,15,18)
InChIKeyGWYIIQJADNCGQX-UHFFFAOYSA-N
MW242.28 g/mol
LogP1.31
Rot. Bonds2

About 3-[2-(6-methyl-3-pyridinyl)imidazol-1-yl]pyrrolidin-2-one

3-[2-(6-methyl-3-pyridinyl)imidazol-1-yl]pyrrolidin-2-one (PubChem CID 155914038) has the molecular formula C13H14N4O and a molecular weight of 242.28 g/mol. Its IUPAC name is 3-[2-(6-methyl-3-pyridinyl)imidazol-1-yl]pyrrolidin-2-one.

Molecular Properties

Compound Name3-[2-(6-methyl-3-pyridinyl)imidazol-1-yl]pyrrolidin-2-one
PubChem CID155914038
Molecular FormulaC13H14N4O
Molecular Weight242.28 g/mol
Exact Mass242.12
IUPAC Name3-[2-(6-methyl-3-pyridinyl)imidazol-1-yl]pyrrolidin-2-one
SMILESCc1ccc(-c2nccn2C2CCNC2=O)cn1
InChIInChI=1S/C13H14N4O/c1-9-2-3-10(8-16-9)12-14-6-7-17(12)11-4-5-15-13(11)18/h2-3,6-8,11H,4-5H2,1H3,(H,15,18)
InChIKeyGWYIIQJADNCGQX-UHFFFAOYSA-N
XLogP1.31
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-pyrazolo[1,5-a]pyridin-7-ylimidazol-1-yl)azepan-2-one
CID 155502833
(3S,4S)-4-(2-pyridin-3-ylimidazol-1-yl)piperidin-3-ol
CID 154818382
trans-(1R,2R)-2-(2-pyridin-3-ylimidazol-1-yl)cyclohexan-1-ol
CID 133264534
1-methyl-3-(6-methyl-3-pyridinyl)pyridin-2-one
CID 171100530
3-(6-methyl-3-pyridinyl)-1H-pyridin-2-one
CID 141047342
1-methyl-3-[2-(3-pyrazol-1-ylphenyl)imidazol-1-yl]pyrrolidin-2-one
CID 146040356
2-methoxy-5-[1-(4-methoxycyclohexyl)imidazol-2-yl]pyridine
CID 165419000
acetic acid;3-(2-cyclopentylimidazol-1-yl)azepan-2-one
CID 163340713
4-[2-(4-bromophenyl)imidazol-1-yl]piperidine
CID 82559669
N-methyl-2-[2-(6-methyl-3-pyridinyl)imidazol-1-yl]propanamide
CID 155910630
3-[4-[(3-methyl-2-pyridinyl)oxy]piperidin-1-yl]pyrrolidin-2-one
CID 126801191
3-(5-chloroindol-1-yl)pyrrolidin-2-one
CID 141178980

Frequently Asked Questions

What is the IUPAC name of 3-[2-(6-methyl-3-pyridinyl)imidazol-1-yl]pyrrolidin-2-one?
The IUPAC name of 3-[2-(6-methyl-3-pyridinyl)imidazol-1-yl]pyrrolidin-2-one (CID 155914038) is 3-[2-(6-methyl-3-pyridinyl)imidazol-1-yl]pyrrolidin-2-one.
What is the SMILES notation for 3-[2-(6-methyl-3-pyridinyl)imidazol-1-yl]pyrrolidin-2-one?
The canonical SMILES for 3-[2-(6-methyl-3-pyridinyl)imidazol-1-yl]pyrrolidin-2-one is Cc1ccc(-c2nccn2C2CCNC2=O)cn1.
What is the InChIKey of 3-[2-(6-methyl-3-pyridinyl)imidazol-1-yl]pyrrolidin-2-one?
The InChIKey is GWYIIQJADNCGQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O/c1-9-2-3-10(8-16-9)12-14-6-7-17(12)11-4-5-15-13(11)18/h2-3,6-8,11H,4-5H2,1H3,(H,15,18).
What are the key properties of 3-[2-(6-methyl-3-pyridinyl)imidazol-1-yl]pyrrolidin-2-one?
3-[2-(6-methyl-3-pyridinyl)imidazol-1-yl]pyrrolidin-2-one has a molecular weight of 242.28 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(6-methyl-3-pyridinyl)imidazol-1-yl]pyrrolidin-2-one is sourced from PubChem (CID 155914038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).