5-methyl-2-naphthalen-2-yl-1,3-thiazinane

C15H17NS — CID 66224808

IUPAC5-methyl-2-naphthalen-2-yl-1,3-thiazinane
SMILESCC1CNC(c2ccc3ccccc3c2)SC1
InChIInChI=1S/C15H17NS/c1-11-9-16-15(17-10-11)14-7-6-12-4-2-3-5-13(12)8-14/h2-8,11,15-16H,9-10H2,1H3
InChIKeyUMJGAVBTTARYJE-UHFFFAOYSA-N
MW243.38 g/mol
LogP3.81
Rot. Bonds1

About 5-methyl-2-naphthalen-2-yl-1,3-thiazinane

5-methyl-2-naphthalen-2-yl-1,3-thiazinane (PubChem CID 66224808) has the molecular formula C15H17NS and a molecular weight of 243.38 g/mol. Its IUPAC name is 5-methyl-2-naphthalen-2-yl-1,3-thiazinane.

Molecular Properties

Compound Name5-methyl-2-naphthalen-2-yl-1,3-thiazinane
PubChem CID66224808
Molecular FormulaC15H17NS
Molecular Weight243.38 g/mol
Exact Mass243.11
IUPAC Name5-methyl-2-naphthalen-2-yl-1,3-thiazinane
SMILESCC1CNC(c2ccc3ccccc3c2)SC1
InChIInChI=1S/C15H17NS/c1-11-9-16-15(17-10-11)14-7-6-12-4-2-3-5-13(12)8-14/h2-8,11,15-16H,9-10H2,1H3
InChIKeyUMJGAVBTTARYJE-UHFFFAOYSA-N
XLogP3.81
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.38
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-naphthalen-2-yl-1,3-thiazinane?
The IUPAC name of 5-methyl-2-naphthalen-2-yl-1,3-thiazinane (CID 66224808) is 5-methyl-2-naphthalen-2-yl-1,3-thiazinane.
What is the SMILES notation for 5-methyl-2-naphthalen-2-yl-1,3-thiazinane?
The canonical SMILES for 5-methyl-2-naphthalen-2-yl-1,3-thiazinane is CC1CNC(c2ccc3ccccc3c2)SC1.
What is the InChIKey of 5-methyl-2-naphthalen-2-yl-1,3-thiazinane?
The InChIKey is UMJGAVBTTARYJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NS/c1-11-9-16-15(17-10-11)14-7-6-12-4-2-3-5-13(12)8-14/h2-8,11,15-16H,9-10H2,1H3.
What are the key properties of 5-methyl-2-naphthalen-2-yl-1,3-thiazinane?
5-methyl-2-naphthalen-2-yl-1,3-thiazinane has a molecular weight of 243.38 g/mol, XLogP of 3.81, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-naphthalen-2-yl-1,3-thiazinane is sourced from PubChem (CID 66224808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).