3-hydroxy-2,2,4,4,6-pentamethyl-1,3-thiazinane

C9H19NOS — CID 142820511

IUPAC3-hydroxy-2,2,4,4,6-pentamethyl-1,3-thiazinane
SMILESCC1CC(C)(C)N(O)C(C)(C)S1
InChIInChI=1S/C9H19NOS/c1-7-6-8(2,3)10(11)9(4,5)12-7/h7,11H,6H2,1-5H3
InChIKeyMSYVPXBSGYNEPI-UHFFFAOYSA-N
MW189.32 g/mol
LogP2.72
Rot. Bonds

About 3-hydroxy-2,2,4,4,6-pentamethyl-1,3-thiazinane

3-hydroxy-2,2,4,4,6-pentamethyl-1,3-thiazinane (PubChem CID 142820511) has the molecular formula C9H19NOS and a molecular weight of 189.32 g/mol. Its IUPAC name is 3-hydroxy-2,2,4,4,6-pentamethyl-1,3-thiazinane.

Molecular Properties

Compound Name3-hydroxy-2,2,4,4,6-pentamethyl-1,3-thiazinane
PubChem CID142820511
Molecular FormulaC9H19NOS
Molecular Weight189.32 g/mol
Exact Mass189.12
IUPAC Name3-hydroxy-2,2,4,4,6-pentamethyl-1,3-thiazinane
SMILESCC1CC(C)(C)N(O)C(C)(C)S1
InChIInChI=1S/C9H19NOS/c1-7-6-8(2,3)10(11)9(4,5)12-7/h7,11H,6H2,1-5H3
InChIKeyMSYVPXBSGYNEPI-UHFFFAOYSA-N
XLogP2.72
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.32
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-hydroxy-2,2,4,6,6-pentamethylpiperidine
CID 162143693
1-hydroxy-N,2,2,6,6-pentamethylpiperidin-4-amine
CID 11853021
1-hydroxy-2,2,5,5-tetramethylpyrrolidin-3-ol
CID 551669
4-ethynyl-1-hydroxy-2,2,6,6-tetramethylpiperidine
CID 154315687
1,1-bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)hydrazine
CID 129171446
1-hydroxy-2,6,6-trimethylpiperidine-2,4-diol
CID 138599858
1-hydroxy-4-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)amino]-2,2,6,6-tetramethylpiperidin-4-ol
CID 173258983
(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) sulfate
CID 20626758
bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-ol);sulfuric acid
CID 173256440
(3S)-1-hydroxy-2,2,5,5-tetramethylpyrrolidine-3-carboxylic acid
CID 854503
2-ethyl-1-hydroxy-2,3,6,6-tetramethylpiperidin-4-ol
CID 143807942
4-ethoxy-1-hydroxy-2,2,6,6-tetramethylpiperidine
CID 18371974

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2,2,4,4,6-pentamethyl-1,3-thiazinane?
The IUPAC name of 3-hydroxy-2,2,4,4,6-pentamethyl-1,3-thiazinane (CID 142820511) is 3-hydroxy-2,2,4,4,6-pentamethyl-1,3-thiazinane.
What is the SMILES notation for 3-hydroxy-2,2,4,4,6-pentamethyl-1,3-thiazinane?
The canonical SMILES for 3-hydroxy-2,2,4,4,6-pentamethyl-1,3-thiazinane is CC1CC(C)(C)N(O)C(C)(C)S1.
What is the InChIKey of 3-hydroxy-2,2,4,4,6-pentamethyl-1,3-thiazinane?
The InChIKey is MSYVPXBSGYNEPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NOS/c1-7-6-8(2,3)10(11)9(4,5)12-7/h7,11H,6H2,1-5H3.
What are the key properties of 3-hydroxy-2,2,4,4,6-pentamethyl-1,3-thiazinane?
3-hydroxy-2,2,4,4,6-pentamethyl-1,3-thiazinane has a molecular weight of 189.32 g/mol, XLogP of 2.72, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2,2,4,4,6-pentamethyl-1,3-thiazinane is sourced from PubChem (CID 142820511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).