6-cyclopropyl-3-methyl-1H-pyridin-2-one

C9H11NO — CID 20641843

IUPAC6-cyclopropyl-3-methyl-1H-pyridin-2-one
SMILESCc1ccc(C2CC2)[nH]c1=O
InChIInChI=1S/C9H11NO/c1-6-2-5-8(7-3-4-7)10-9(6)11/h2,5,7H,3-4H2,1H3,(H,10,11)
InChIKeyQNICRCBETZEMLA-UHFFFAOYSA-N
MW149.19 g/mol
LogP1.56
Rot. Bonds1

About 6-cyclopropyl-3-methyl-1H-pyridin-2-one

6-cyclopropyl-3-methyl-1H-pyridin-2-one (PubChem CID 20641843) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is 6-cyclopropyl-3-methyl-1H-pyridin-2-one.

Molecular Properties

Compound Name6-cyclopropyl-3-methyl-1H-pyridin-2-one
PubChem CID20641843
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name6-cyclopropyl-3-methyl-1H-pyridin-2-one
SMILESCc1ccc(C2CC2)[nH]c1=O
InChIInChI=1S/C9H11NO/c1-6-2-5-8(7-3-4-7)10-9(6)11/h2,5,7H,3-4H2,1H3,(H,10,11)
InChIKeyQNICRCBETZEMLA-UHFFFAOYSA-N
XLogP1.56
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-3-methyl-1H-pyridin-2-one?
The IUPAC name of 6-cyclopropyl-3-methyl-1H-pyridin-2-one (CID 20641843) is 6-cyclopropyl-3-methyl-1H-pyridin-2-one.
What is the SMILES notation for 6-cyclopropyl-3-methyl-1H-pyridin-2-one?
The canonical SMILES for 6-cyclopropyl-3-methyl-1H-pyridin-2-one is Cc1ccc(C2CC2)[nH]c1=O.
What is the InChIKey of 6-cyclopropyl-3-methyl-1H-pyridin-2-one?
The InChIKey is QNICRCBETZEMLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11NO/c1-6-2-5-8(7-3-4-7)10-9(6)11/h2,5,7H,3-4H2,1H3,(H,10,11).
What are the key properties of 6-cyclopropyl-3-methyl-1H-pyridin-2-one?
6-cyclopropyl-3-methyl-1H-pyridin-2-one has a molecular weight of 149.19 g/mol, XLogP of 1.56, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-3-methyl-1H-pyridin-2-one is sourced from PubChem (CID 20641843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).