6-ethyl-3-methyl-5-(pyridine-2-carbonyl)-1H-pyridin-2-one

C14H14N2O2 — CID 21293564

IUPAC6-ethyl-3-methyl-5-(pyridine-2-carbonyl)-1H-pyridin-2-one
SMILESCCc1[nH]c(=O)c(C)cc1C(=O)c1ccccn1
InChIInChI=1S/C14H14N2O2/c1-3-11-10(8-9(2)14(18)16-11)13(17)12-6-4-5-7-15-12/h4-8H,3H2,1-2H3,(H,16,18)
InChIKeyXGSVTWGEHIYERI-UHFFFAOYSA-N
MW242.28 g/mol
LogP1.87
Rot. Bonds3

About 6-ethyl-3-methyl-5-(pyridine-2-carbonyl)-1H-pyridin-2-one

6-ethyl-3-methyl-5-(pyridine-2-carbonyl)-1H-pyridin-2-one (PubChem CID 21293564) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 6-ethyl-3-methyl-5-(pyridine-2-carbonyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name6-ethyl-3-methyl-5-(pyridine-2-carbonyl)-1H-pyridin-2-one
PubChem CID21293564
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name6-ethyl-3-methyl-5-(pyridine-2-carbonyl)-1H-pyridin-2-one
SMILESCCc1[nH]c(=O)c(C)cc1C(=O)c1ccccn1
InChIInChI=1S/C14H14N2O2/c1-3-11-10(8-9(2)14(18)16-11)13(17)12-6-4-5-7-15-12/h4-8H,3H2,1-2H3,(H,16,18)
InChIKeyXGSVTWGEHIYERI-UHFFFAOYSA-N
XLogP1.87
TPSA62.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-6-ethyl-5-(pyridine-2-carbonyl)-1H-pyridin-2-one
CID 21293540
(2-methyl-5-nitrophenyl)-pyridin-2-ylmethanone
CID 118813911
6-ethyl-3-methyl-5-pyridin-4-yl-1H-pyridin-2-one
CID 70513872
CID 173156131
CID 173156131
pyrazin-2-yl(pyridin-2-yl)methanone
CID 22931525
[2-[(2-methylphenoxy)methyl]phenyl]-pyridin-2-ylmethanone
CID 21264597
(3-bromo-2-methylphenyl)-pyridin-2-ylmethanone
CID 118836322
ethyl pyridine-2-carboxylate
CID 17307
ethyl 4-(pyridine-2-carbonyl)-1H-pyrrole-2-carboxylate
CID 168911940
(2,5-dichlorophenyl)-pyridin-2-ylmethanone
CID 16638529
gadolinium;pyridine-2-carboxylic acid
CID 175231422
[4-methyl-2-(pyridine-2-carbonyl)phenyl] acetate
CID 102227246

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-3-methyl-5-(pyridine-2-carbonyl)-1H-pyridin-2-one?
The IUPAC name of 6-ethyl-3-methyl-5-(pyridine-2-carbonyl)-1H-pyridin-2-one (CID 21293564) is 6-ethyl-3-methyl-5-(pyridine-2-carbonyl)-1H-pyridin-2-one.
What is the SMILES notation for 6-ethyl-3-methyl-5-(pyridine-2-carbonyl)-1H-pyridin-2-one?
The canonical SMILES for 6-ethyl-3-methyl-5-(pyridine-2-carbonyl)-1H-pyridin-2-one is CCc1[nH]c(=O)c(C)cc1C(=O)c1ccccn1.
What is the InChIKey of 6-ethyl-3-methyl-5-(pyridine-2-carbonyl)-1H-pyridin-2-one?
The InChIKey is XGSVTWGEHIYERI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-3-11-10(8-9(2)14(18)16-11)13(17)12-6-4-5-7-15-12/h4-8H,3H2,1-2H3,(H,16,18).
What are the key properties of 6-ethyl-3-methyl-5-(pyridine-2-carbonyl)-1H-pyridin-2-one?
6-ethyl-3-methyl-5-(pyridine-2-carbonyl)-1H-pyridin-2-one has a molecular weight of 242.28 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-3-methyl-5-(pyridine-2-carbonyl)-1H-pyridin-2-one is sourced from PubChem (CID 21293564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).