3,5-diethyl-1H-pyridin-2-one

C9H13NO — CID 20872596

IUPAC3,5-diethyl-1H-pyridin-2-one
SMILESCCc1c[nH]c(=O)c(CC)c1
InChIInChI=1S/C9H13NO/c1-3-7-5-8(4-2)9(11)10-6-7/h5-6H,3-4H2,1-2H3,(H,10,11)
InChIKeyZZXHZQSHSABVFU-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.50
Rot. Bonds2

About 3,5-diethyl-1H-pyridin-2-one

3,5-diethyl-1H-pyridin-2-one (PubChem CID 20872596) has the molecular formula C9H13NO and a molecular weight of 151.21 g/mol. Its IUPAC name is 3,5-diethyl-1H-pyridin-2-one.

Molecular Properties

Compound Name3,5-diethyl-1H-pyridin-2-one
PubChem CID20872596
Molecular FormulaC9H13NO
Molecular Weight151.21 g/mol
Exact Mass151.10
IUPAC Name3,5-diethyl-1H-pyridin-2-one
SMILESCCc1c[nH]c(=O)c(CC)c1
InChIInChI=1S/C9H13NO/c1-3-7-5-8(4-2)9(11)10-6-7/h5-6H,3-4H2,1-2H3,(H,10,11)
InChIKeyZZXHZQSHSABVFU-UHFFFAOYSA-N
XLogP1.50
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1,6-Dihydro-N-methyl-6-oxonicotinamide
CID 70510
3-Ethylpyridin-2-ol
CID 12354337
5-Dimethylaminomethyl-1H-pyridin-2-one
CID 14846982
3,5-Dimethyl-1,2-dihydropyridin-2-one
CID 12348538
N,1-dimethyl-6-oxo-1,6-dihydropyridine-3-carboxamide
CID 12374555
5-Ethyl-2-pyridinol
CID 19365871
N,N-dimethyl-6-oxo-1,6-dihydropyridine-3-carboxamide
CID 19692588
3-Tert-butyl-1,2-dihydropyridin-2-one
CID 57588057
3-(Aminomethyl)-5-methylpyridin-2-ol
CID 62652428
3,3'-Bipyridine-2,2'-diol
CID 824616
3-(Aminomethyl)-5-methyl-1,2-dihydropyridin-2-one hydrochloride
CID 91647545
Diethylpyridinone
CID 20040028

Frequently Asked Questions

What is the IUPAC name of 3,5-diethyl-1H-pyridin-2-one?
The IUPAC name of 3,5-diethyl-1H-pyridin-2-one (CID 20872596) is 3,5-diethyl-1H-pyridin-2-one.
What is the SMILES notation for 3,5-diethyl-1H-pyridin-2-one?
The canonical SMILES for 3,5-diethyl-1H-pyridin-2-one is CCc1c[nH]c(=O)c(CC)c1.
What is the InChIKey of 3,5-diethyl-1H-pyridin-2-one?
The InChIKey is ZZXHZQSHSABVFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13NO/c1-3-7-5-8(4-2)9(11)10-6-7/h5-6H,3-4H2,1-2H3,(H,10,11).
What are the key properties of 3,5-diethyl-1H-pyridin-2-one?
3,5-diethyl-1H-pyridin-2-one has a molecular weight of 151.21 g/mol, XLogP of 1.50, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diethyl-1H-pyridin-2-one is sourced from PubChem (CID 20872596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).