N-(2-methoxypropyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine

C9H18N2OS — CID 102699426

IUPACN-(2-methoxypropyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCOC(C)CNC1=NCC(C)CS1
InChIInChI=1S/C9H18N2OS/c1-7-4-10-9(13-6-7)11-5-8(2)12-3/h7-8H,4-6H2,1-3H3,(H,10,11)
InChIKeyGWHHRLCFYITRPW-UHFFFAOYSA-N
MW202.32 g/mol
LogP1.35
Rot. Bonds3

About N-(2-methoxypropyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine

N-(2-methoxypropyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine (PubChem CID 102699426) has the molecular formula C9H18N2OS and a molecular weight of 202.32 g/mol. Its IUPAC name is N-(2-methoxypropyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine.

Molecular Properties

Compound NameN-(2-methoxypropyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine
PubChem CID102699426
Molecular FormulaC9H18N2OS
Molecular Weight202.32 g/mol
Exact Mass202.11
IUPAC NameN-(2-methoxypropyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCOC(C)CNC1=NCC(C)CS1
InChIInChI=1S/C9H18N2OS/c1-7-4-10-9(13-6-7)11-5-8(2)12-3/h7-8H,4-6H2,1-3H3,(H,10,11)
InChIKeyGWHHRLCFYITRPW-UHFFFAOYSA-N
XLogP1.35
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.32
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxypropyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine?
The IUPAC name of N-(2-methoxypropyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine (CID 102699426) is N-(2-methoxypropyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine.
What is the SMILES notation for N-(2-methoxypropyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine?
The canonical SMILES for N-(2-methoxypropyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine is COC(C)CNC1=NCC(C)CS1.
What is the InChIKey of N-(2-methoxypropyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine?
The InChIKey is GWHHRLCFYITRPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2OS/c1-7-4-10-9(13-6-7)11-5-8(2)12-3/h7-8H,4-6H2,1-3H3,(H,10,11).
What are the key properties of N-(2-methoxypropyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine?
N-(2-methoxypropyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine has a molecular weight of 202.32 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxypropyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine is sourced from PubChem (CID 102699426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).