5-methyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-5,6-dihydro-4H-1,3-thiazin-2-amine

C15H26N2S — CID 65034949

IUPAC5-methyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCC1CN=C(NC2C3(C)CCC(C3)C2(C)C)SC1
InChIInChI=1S/C15H26N2S/c1-10-8-16-13(18-9-10)17-12-14(2,3)11-5-6-15(12,4)7-11/h10-12H,5-9H2,1-4H3,(H,16,17)
InChIKeyZUCIYKXHSUWLEZ-UHFFFAOYSA-N
MW266.45 g/mol
LogP3.53
Rot. Bonds1

About 5-methyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-5,6-dihydro-4H-1,3-thiazin-2-amine

5-methyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-5,6-dihydro-4H-1,3-thiazin-2-amine (PubChem CID 65034949) has the molecular formula C15H26N2S and a molecular weight of 266.45 g/mol. Its IUPAC name is 5-methyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-5,6-dihydro-4H-1,3-thiazin-2-amine.

Molecular Properties

Compound Name5-methyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
PubChem CID65034949
Molecular FormulaC15H26N2S
Molecular Weight266.45 g/mol
Exact Mass266.18
IUPAC Name5-methyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCC1CN=C(NC2C3(C)CCC(C3)C2(C)C)SC1
InChIInChI=1S/C15H26N2S/c1-10-8-16-13(18-9-10)17-12-14(2,3)11-5-6-15(12,4)7-11/h10-12H,5-9H2,1-4H3,(H,16,17)
InChIKeyZUCIYKXHSUWLEZ-UHFFFAOYSA-N
XLogP3.53
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.45
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The IUPAC name of 5-methyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-5,6-dihydro-4H-1,3-thiazin-2-amine (CID 65034949) is 5-methyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-5,6-dihydro-4H-1,3-thiazin-2-amine.
What is the SMILES notation for 5-methyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The canonical SMILES for 5-methyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-5,6-dihydro-4H-1,3-thiazin-2-amine is CC1CN=C(NC2C3(C)CCC(C3)C2(C)C)SC1.
What is the InChIKey of 5-methyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The InChIKey is ZUCIYKXHSUWLEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2S/c1-10-8-16-13(18-9-10)17-12-14(2,3)11-5-6-15(12,4)7-11/h10-12H,5-9H2,1-4H3,(H,16,17).
What are the key properties of 5-methyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
5-methyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-5,6-dihydro-4H-1,3-thiazin-2-amine has a molecular weight of 266.45 g/mol, XLogP of 3.53, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl)-5,6-dihydro-4H-1,3-thiazin-2-amine is sourced from PubChem (CID 65034949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).