4-methyl-3-pyrrolidin-1-yl-1H-pyridin-2-one

C10H14N2O — CID 67845675

IUPAC4-methyl-3-pyrrolidin-1-yl-1H-pyridin-2-one
SMILESCc1cc[nH]c(=O)c1N1CCCC1
InChIInChI=1S/C10H14N2O/c1-8-4-5-11-10(13)9(8)12-6-2-3-7-12/h4-5H,2-3,6-7H2,1H3,(H,11,13)
InChIKeyWGCKTIYTKICZJJ-UHFFFAOYSA-N
MW178.24 g/mol
LogP1.28
Rot. Bonds1

About 4-methyl-3-pyrrolidin-1-yl-1H-pyridin-2-one

4-methyl-3-pyrrolidin-1-yl-1H-pyridin-2-one (PubChem CID 67845675) has the molecular formula C10H14N2O and a molecular weight of 178.24 g/mol. Its IUPAC name is 4-methyl-3-pyrrolidin-1-yl-1H-pyridin-2-one.

Molecular Properties

Compound Name4-methyl-3-pyrrolidin-1-yl-1H-pyridin-2-one
PubChem CID67845675
Molecular FormulaC10H14N2O
Molecular Weight178.24 g/mol
Exact Mass178.11
IUPAC Name4-methyl-3-pyrrolidin-1-yl-1H-pyridin-2-one
SMILESCc1cc[nH]c(=O)c1N1CCCC1
InChIInChI=1S/C10H14N2O/c1-8-4-5-11-10(13)9(8)12-6-2-3-7-12/h4-5H,2-3,6-7H2,1H3,(H,11,13)
InChIKeyWGCKTIYTKICZJJ-UHFFFAOYSA-N
XLogP1.28
TPSA36.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.24
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-pyrrolidin-1-yl-1H-pyridin-2-one?
The IUPAC name of 4-methyl-3-pyrrolidin-1-yl-1H-pyridin-2-one (CID 67845675) is 4-methyl-3-pyrrolidin-1-yl-1H-pyridin-2-one.
What is the SMILES notation for 4-methyl-3-pyrrolidin-1-yl-1H-pyridin-2-one?
The canonical SMILES for 4-methyl-3-pyrrolidin-1-yl-1H-pyridin-2-one is Cc1cc[nH]c(=O)c1N1CCCC1.
What is the InChIKey of 4-methyl-3-pyrrolidin-1-yl-1H-pyridin-2-one?
The InChIKey is WGCKTIYTKICZJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-8-4-5-11-10(13)9(8)12-6-2-3-7-12/h4-5H,2-3,6-7H2,1H3,(H,11,13).
What are the key properties of 4-methyl-3-pyrrolidin-1-yl-1H-pyridin-2-one?
4-methyl-3-pyrrolidin-1-yl-1H-pyridin-2-one has a molecular weight of 178.24 g/mol, XLogP of 1.28, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-pyrrolidin-1-yl-1H-pyridin-2-one is sourced from PubChem (CID 67845675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).