6-(1-oxo-1,4-thiazinan-4-yl)hexan-1-ol

C10H21NO2S — CID 103737950

IUPAC6-(1-oxo-1,4-thiazinan-4-yl)hexan-1-ol
SMILESO=S1CCN(CCCCCCO)CC1
InChIInChI=1S/C10H21NO2S/c12-8-4-2-1-3-5-11-6-9-14(13)10-7-11/h12H,1-10H2
InChIKeyFTZJZCSIOAWICO-UHFFFAOYSA-N
MW219.35 g/mol
LogP0.60
Rot. Bonds6

About 6-(1-oxo-1,4-thiazinan-4-yl)hexan-1-ol

6-(1-oxo-1,4-thiazinan-4-yl)hexan-1-ol (PubChem CID 103737950) has the molecular formula C10H21NO2S and a molecular weight of 219.35 g/mol. Its IUPAC name is 6-(1-oxo-1,4-thiazinan-4-yl)hexan-1-ol.

Molecular Properties

Compound Name6-(1-oxo-1,4-thiazinan-4-yl)hexan-1-ol
PubChem CID103737950
Molecular FormulaC10H21NO2S
Molecular Weight219.35 g/mol
Exact Mass219.13
IUPAC Name6-(1-oxo-1,4-thiazinan-4-yl)hexan-1-ol
SMILESO=S1CCN(CCCCCCO)CC1
InChIInChI=1S/C10H21NO2S/c12-8-4-2-1-3-5-11-6-9-14(13)10-7-11/h12H,1-10H2
InChIKeyFTZJZCSIOAWICO-UHFFFAOYSA-N
XLogP0.60
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.35
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

10-piperidin-1-yldecan-1-ol
CID 22218518
6-(azacyclotridec-1-yl)hexan-1-ol
CID 101161993
10-(4-methylpiperazin-1-yl)decan-1-ol;12-(4-methylpiperazin-1-yl)dodecan-1-ol
CID 22218533
9-morpholin-4-ylnonan-1-ol
CID 58205558
20-morpholin-4-ylicosan-1-ol
CID 58205553
2-amino-4-(1-oxo-1,4-thiazinan-4-yl)butanoic acid
CID 63053759
6-(4-aminopiperidin-1-yl)hexan-1-ol
CID 70276836
6-[4-(hydroxymethyl)piperidin-1-yl]hexan-1-ol
CID 103737785
2,2-dimethyl-6-(1-oxo-1,4-thiazinan-4-yl)hexanenitrile
CID 106709915
methyl 3-[4-(5-hydroxypentyl)piperazin-1-yl]propanoate
CID 78918620
methyl 3-[4-(6-hydroxyhexyl)piperazin-1-yl]propanoate
CID 113252132
5-[4-(3-methylbutyl)piperazin-1-yl]pentan-1-ol
CID 110923815

Frequently Asked Questions

What is the IUPAC name of 6-(1-oxo-1,4-thiazinan-4-yl)hexan-1-ol?
The IUPAC name of 6-(1-oxo-1,4-thiazinan-4-yl)hexan-1-ol (CID 103737950) is 6-(1-oxo-1,4-thiazinan-4-yl)hexan-1-ol.
What is the SMILES notation for 6-(1-oxo-1,4-thiazinan-4-yl)hexan-1-ol?
The canonical SMILES for 6-(1-oxo-1,4-thiazinan-4-yl)hexan-1-ol is O=S1CCN(CCCCCCO)CC1.
What is the InChIKey of 6-(1-oxo-1,4-thiazinan-4-yl)hexan-1-ol?
The InChIKey is FTZJZCSIOAWICO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2S/c12-8-4-2-1-3-5-11-6-9-14(13)10-7-11/h12H,1-10H2.
What are the key properties of 6-(1-oxo-1,4-thiazinan-4-yl)hexan-1-ol?
6-(1-oxo-1,4-thiazinan-4-yl)hexan-1-ol has a molecular weight of 219.35 g/mol, XLogP of 0.60, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-oxo-1,4-thiazinan-4-yl)hexan-1-ol is sourced from PubChem (CID 103737950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).