1,2,3,6-tetramethyl-2,3-dihydropyridin-4-one

C9H15NO — CID 54403371

IUPAC1,2,3,6-tetramethyl-2,3-dihydropyridin-4-one
SMILESCC1=CC(=O)C(C)C(C)N1C
InChIInChI=1S/C9H15NO/c1-6-5-9(11)7(2)8(3)10(6)4/h5,7-8H,1-4H3
InChIKeyVOZUDQVJIBEHNL-UHFFFAOYSA-N
MW153.22 g/mol
LogP1.43
Rot. Bonds

About 1,2,3,6-tetramethyl-2,3-dihydropyridin-4-one

1,2,3,6-tetramethyl-2,3-dihydropyridin-4-one (PubChem CID 54403371) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is 1,2,3,6-tetramethyl-2,3-dihydropyridin-4-one.

Molecular Properties

Compound Name1,2,3,6-tetramethyl-2,3-dihydropyridin-4-one
PubChem CID54403371
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name1,2,3,6-tetramethyl-2,3-dihydropyridin-4-one
SMILESCC1=CC(=O)C(C)C(C)N1C
InChIInChI=1S/C9H15NO/c1-6-5-9(11)7(2)8(3)10(6)4/h5,7-8H,1-4H3
InChIKeyVOZUDQVJIBEHNL-UHFFFAOYSA-N
XLogP1.43
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,6-tetramethyl-2,3-dihydropyridin-4-one?
The IUPAC name of 1,2,3,6-tetramethyl-2,3-dihydropyridin-4-one (CID 54403371) is 1,2,3,6-tetramethyl-2,3-dihydropyridin-4-one.
What is the SMILES notation for 1,2,3,6-tetramethyl-2,3-dihydropyridin-4-one?
The canonical SMILES for 1,2,3,6-tetramethyl-2,3-dihydropyridin-4-one is CC1=CC(=O)C(C)C(C)N1C.
What is the InChIKey of 1,2,3,6-tetramethyl-2,3-dihydropyridin-4-one?
The InChIKey is VOZUDQVJIBEHNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-6-5-9(11)7(2)8(3)10(6)4/h5,7-8H,1-4H3.
What are the key properties of 1,2,3,6-tetramethyl-2,3-dihydropyridin-4-one?
1,2,3,6-tetramethyl-2,3-dihydropyridin-4-one has a molecular weight of 153.22 g/mol, XLogP of 1.43, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,6-tetramethyl-2,3-dihydropyridin-4-one is sourced from PubChem (CID 54403371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).