1-(2-methyl-4-pyridinyl)pyrrolidin-2-one

C10H12N2O — CID 70517179

IUPAC1-(2-methyl-4-pyridinyl)pyrrolidin-2-one
SMILESCc1cc(N2CCCC2=O)ccn1
InChIInChI=1S/C10H12N2O/c1-8-7-9(4-5-11-8)12-6-2-3-10(12)13/h4-5,7H,2-3,6H2,1H3
InChIKeyUEVOOZQGRSFFLB-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.52
Rot. Bonds1

About 1-(2-methyl-4-pyridinyl)pyrrolidin-2-one

1-(2-methyl-4-pyridinyl)pyrrolidin-2-one (PubChem CID 70517179) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is 1-(2-methyl-4-pyridinyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(2-methyl-4-pyridinyl)pyrrolidin-2-one
PubChem CID70517179
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name1-(2-methyl-4-pyridinyl)pyrrolidin-2-one
SMILESCc1cc(N2CCCC2=O)ccn1
InChIInChI=1S/C10H12N2O/c1-8-7-9(4-5-11-8)12-6-2-3-10(12)13/h4-5,7H,2-3,6H2,1H3
InChIKeyUEVOOZQGRSFFLB-UHFFFAOYSA-N
XLogP1.52
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(trifluoromethyl)-4-pyridinyl]pyrrolidin-2-one
CID 166609012
1-(2-methyl-4-pyridinyl)imidazolidin-2-one
CID 170628851
1-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidin-2-one
CID 822790
1-(3,5-dimethylphenyl)pyrrolidin-2-one
CID 847897
1-(3-iodo-4-methylphenyl)pyrrolidin-2-one
CID 70646399
ethane;1-(4-methylphenyl)pyrrolidin-2-one
CID 143607645
1-[4-methyl-3-(trifluoromethyl)phenyl]pyrrolidin-2-one
CID 70195701
1-[2-[(1S,2S)-3-(3,5-difluorophenyl)-1-hydroxy-2-methylpropyl]-4-pyridinyl]pyrrolidin-2-one
CID 71173903
1-(4,6-dimethylpyrimidin-2-yl)pyrrolidin-2-one
CID 166608936
1-[3-[(6-methyl-3-pyridinyl)methylamino]phenyl]pyrrolidin-2-one
CID 104749314
1-(3,5-dipyridin-2-ylphenyl)pyrrolidin-2-one
CID 172517347
1-[3-[3-(2-oxopyrrolidin-1-yl)phenoxy]phenyl]pyrrolidin-2-one
CID 142760205

Frequently Asked Questions

What is the IUPAC name of 1-(2-methyl-4-pyridinyl)pyrrolidin-2-one?
The IUPAC name of 1-(2-methyl-4-pyridinyl)pyrrolidin-2-one (CID 70517179) is 1-(2-methyl-4-pyridinyl)pyrrolidin-2-one.
What is the SMILES notation for 1-(2-methyl-4-pyridinyl)pyrrolidin-2-one?
The canonical SMILES for 1-(2-methyl-4-pyridinyl)pyrrolidin-2-one is Cc1cc(N2CCCC2=O)ccn1.
What is the InChIKey of 1-(2-methyl-4-pyridinyl)pyrrolidin-2-one?
The InChIKey is UEVOOZQGRSFFLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c1-8-7-9(4-5-11-8)12-6-2-3-10(12)13/h4-5,7H,2-3,6H2,1H3.
What are the key properties of 1-(2-methyl-4-pyridinyl)pyrrolidin-2-one?
1-(2-methyl-4-pyridinyl)pyrrolidin-2-one has a molecular weight of 176.22 g/mol, XLogP of 1.52, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methyl-4-pyridinyl)pyrrolidin-2-one is sourced from PubChem (CID 70517179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).