(2S)-1,2,4,5-tetramethyl-2,3-dihydropyridin-6-one

C9H15NO — CID 174095161

IUPAC(2S)-1,2,4,5-tetramethyl-2,3-dihydropyridin-6-one
SMILESCC1=C(C)C(=O)N(C)[C@@H](C)C1
InChIInChI=1S/C9H15NO/c1-6-5-7(2)10(4)9(11)8(6)3/h7H,5H2,1-4H3/t7-/m0/s1
InChIKeyUEDMNICDMCUHKE-ZETCQYMHSA-N
MW153.22 g/mol
LogP1.57
Rot. Bonds

About (2S)-1,2,4,5-tetramethyl-2,3-dihydropyridin-6-one

(2S)-1,2,4,5-tetramethyl-2,3-dihydropyridin-6-one (PubChem CID 174095161) has the molecular formula C9H15NO and a molecular weight of 153.22 g/mol. Its IUPAC name is (2S)-1,2,4,5-tetramethyl-2,3-dihydropyridin-6-one.

Molecular Properties

Compound Name(2S)-1,2,4,5-tetramethyl-2,3-dihydropyridin-6-one
PubChem CID174095161
Molecular FormulaC9H15NO
Molecular Weight153.22 g/mol
Exact Mass153.12
IUPAC Name(2S)-1,2,4,5-tetramethyl-2,3-dihydropyridin-6-one
SMILESCC1=C(C)C(=O)N(C)[C@@H](C)C1
InChIInChI=1S/C9H15NO/c1-6-5-7(2)10(4)9(11)8(6)3/h7H,5H2,1-4H3/t7-/m0/s1
InChIKeyUEDMNICDMCUHKE-ZETCQYMHSA-N
XLogP1.57
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.22
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (2S)-1,2,4,5-tetramethyl-2,3-dihydropyridin-6-one?
The IUPAC name of (2S)-1,2,4,5-tetramethyl-2,3-dihydropyridin-6-one (CID 174095161) is (2S)-1,2,4,5-tetramethyl-2,3-dihydropyridin-6-one.
What is the SMILES notation for (2S)-1,2,4,5-tetramethyl-2,3-dihydropyridin-6-one?
The canonical SMILES for (2S)-1,2,4,5-tetramethyl-2,3-dihydropyridin-6-one is CC1=C(C)C(=O)N(C)[C@@H](C)C1.
What is the InChIKey of (2S)-1,2,4,5-tetramethyl-2,3-dihydropyridin-6-one?
The InChIKey is UEDMNICDMCUHKE-ZETCQYMHSA-N. The full InChI is InChI=1S/C9H15NO/c1-6-5-7(2)10(4)9(11)8(6)3/h7H,5H2,1-4H3/t7-/m0/s1.
What are the key properties of (2S)-1,2,4,5-tetramethyl-2,3-dihydropyridin-6-one?
(2S)-1,2,4,5-tetramethyl-2,3-dihydropyridin-6-one has a molecular weight of 153.22 g/mol, XLogP of 1.57, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-1,2,4,5-tetramethyl-2,3-dihydropyridin-6-one is sourced from PubChem (CID 174095161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).