(2S,3S)-2,3-dihydroxy-1-methyl-2,3-dihydropyridin-6-one

C6H9NO3 — CID 11159377

IUPAC(2S,3S)-2,3-dihydroxy-1-methyl-2,3-dihydropyridin-6-one
SMILESCN1C(=O)C=C[C@H](O)[C@@H]1O
InChIInChI=1S/C6H9NO3/c1-7-5(9)3-2-4(8)6(7)10/h2-4,6,8,10H,1H3/t4-,6-/m0/s1
InChIKeyFMGRBMKZKOMTOL-NJGYIYPDSA-N
MW143.14 g/mol
LogP-1.31
Rot. Bonds

About (2S,3S)-2,3-dihydroxy-1-methyl-2,3-dihydropyridin-6-one

(2S,3S)-2,3-dihydroxy-1-methyl-2,3-dihydropyridin-6-one (PubChem CID 11159377) has the molecular formula C6H9NO3 and a molecular weight of 143.14 g/mol. Its IUPAC name is (2S,3S)-2,3-dihydroxy-1-methyl-2,3-dihydropyridin-6-one.

Molecular Properties

Compound Name(2S,3S)-2,3-dihydroxy-1-methyl-2,3-dihydropyridin-6-one
PubChem CID11159377
Molecular FormulaC6H9NO3
Molecular Weight143.14 g/mol
Exact Mass143.06
IUPAC Name(2S,3S)-2,3-dihydroxy-1-methyl-2,3-dihydropyridin-6-one
SMILESCN1C(=O)C=C[C@H](O)[C@@H]1O
InChIInChI=1S/C6H9NO3/c1-7-5(9)3-2-4(8)6(7)10/h2-4,6,8,10H,1H3/t4-,6-/m0/s1
InChIKeyFMGRBMKZKOMTOL-NJGYIYPDSA-N
XLogP-1.31
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.14
LogP ≤ 5-1.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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3-chloro-2-hydroxy-1-methyl-2H-pyrrol-5-one
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1,2-dimethyl-2,3-dihydropyridin-6-one
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Frequently Asked Questions

What is the IUPAC name of (2S,3S)-2,3-dihydroxy-1-methyl-2,3-dihydropyridin-6-one?
The IUPAC name of (2S,3S)-2,3-dihydroxy-1-methyl-2,3-dihydropyridin-6-one (CID 11159377) is (2S,3S)-2,3-dihydroxy-1-methyl-2,3-dihydropyridin-6-one.
What is the SMILES notation for (2S,3S)-2,3-dihydroxy-1-methyl-2,3-dihydropyridin-6-one?
The canonical SMILES for (2S,3S)-2,3-dihydroxy-1-methyl-2,3-dihydropyridin-6-one is CN1C(=O)C=C[C@H](O)[C@@H]1O.
What is the InChIKey of (2S,3S)-2,3-dihydroxy-1-methyl-2,3-dihydropyridin-6-one?
The InChIKey is FMGRBMKZKOMTOL-NJGYIYPDSA-N. The full InChI is InChI=1S/C6H9NO3/c1-7-5(9)3-2-4(8)6(7)10/h2-4,6,8,10H,1H3/t4-,6-/m0/s1.
What are the key properties of (2S,3S)-2,3-dihydroxy-1-methyl-2,3-dihydropyridin-6-one?
(2S,3S)-2,3-dihydroxy-1-methyl-2,3-dihydropyridin-6-one has a molecular weight of 143.14 g/mol, XLogP of -1.31, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S)-2,3-dihydroxy-1-methyl-2,3-dihydropyridin-6-one is sourced from PubChem (CID 11159377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).