5-(1-methyl-5-oxopyrrolidin-2-yl)-1H-pyridin-2-one

C10H12N2O2 — CID 22073666

IUPAC5-(1-methyl-5-oxopyrrolidin-2-yl)-1H-pyridin-2-one
SMILESCN1C(=O)CCC1c1ccc(=O)[nH]c1
InChIInChI=1S/C10H12N2O2/c1-12-8(3-5-10(12)14)7-2-4-9(13)11-6-7/h2,4,6,8H,3,5H2,1H3,(H,11,13)
InChIKeyRJWKEADXEAOTGJ-UHFFFAOYSA-N
MW192.22 g/mol
LogP0.67
Rot. Bonds1

About 5-(1-methyl-5-oxopyrrolidin-2-yl)-1H-pyridin-2-one

5-(1-methyl-5-oxopyrrolidin-2-yl)-1H-pyridin-2-one (PubChem CID 22073666) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is 5-(1-methyl-5-oxopyrrolidin-2-yl)-1H-pyridin-2-one.

Molecular Properties

Compound Name5-(1-methyl-5-oxopyrrolidin-2-yl)-1H-pyridin-2-one
PubChem CID22073666
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name5-(1-methyl-5-oxopyrrolidin-2-yl)-1H-pyridin-2-one
SMILESCN1C(=O)CCC1c1ccc(=O)[nH]c1
InChIInChI=1S/C10H12N2O2/c1-12-8(3-5-10(12)14)7-2-4-9(13)11-6-7/h2,4,6,8H,3,5H2,1H3,(H,11,13)
InChIKeyRJWKEADXEAOTGJ-UHFFFAOYSA-N
XLogP0.67
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-[(2R)-1-methylpyrrolidin-2-yl]pyridin-2-ol
CID 439886
6-Hydroxynicotine
CID 249885
(S)-6-Hydroxynicotine
CID 439383
(S)-6-hydroxynicotinium(1+)
CID 6955053
(R)-6-hydroxynicotinium
CID 11860612
4-amino-N-propylcyclopentene-1-carboxamide
CID 71746980
4-amino-N-pentylcyclopentene-1-carboxamide
CID 71746981
1-[2-(2-Oxopyrrolidin-1-yl)ethyl]-6-(propan-2-ylamino)-5,6,7,8-tetrahydroquinolin-2-one
CID 118742944
3-(Pyrrolidin-2-yl)pyridin-2-ol hydrochloride
CID 154577018
5-(Pyrrolidin-2-yl)pyridin-2-ol dihydrochloride
CID 155820314
5-(Pyrrolidin-2-yl)pyridin-2-ol
CID 55292345
3-(Pyrrolidin-2-yl)pyridin-2-ol
CID 55293976

Frequently Asked Questions

What is the IUPAC name of 5-(1-methyl-5-oxopyrrolidin-2-yl)-1H-pyridin-2-one?
The IUPAC name of 5-(1-methyl-5-oxopyrrolidin-2-yl)-1H-pyridin-2-one (CID 22073666) is 5-(1-methyl-5-oxopyrrolidin-2-yl)-1H-pyridin-2-one.
What is the SMILES notation for 5-(1-methyl-5-oxopyrrolidin-2-yl)-1H-pyridin-2-one?
The canonical SMILES for 5-(1-methyl-5-oxopyrrolidin-2-yl)-1H-pyridin-2-one is CN1C(=O)CCC1c1ccc(=O)[nH]c1.
What is the InChIKey of 5-(1-methyl-5-oxopyrrolidin-2-yl)-1H-pyridin-2-one?
The InChIKey is RJWKEADXEAOTGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-12-8(3-5-10(12)14)7-2-4-9(13)11-6-7/h2,4,6,8H,3,5H2,1H3,(H,11,13).
What are the key properties of 5-(1-methyl-5-oxopyrrolidin-2-yl)-1H-pyridin-2-one?
5-(1-methyl-5-oxopyrrolidin-2-yl)-1H-pyridin-2-one has a molecular weight of 192.22 g/mol, XLogP of 0.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methyl-5-oxopyrrolidin-2-yl)-1H-pyridin-2-one is sourced from PubChem (CID 22073666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).