N-[2-(2-methoxyethoxy)ethyl]-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine

C10H20N2O2S — CID 65036126

IUPACN-[2-(2-methoxyethoxy)ethyl]-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCOCCOCCNC1=NCC(C)CS1
InChIInChI=1S/C10H20N2O2S/c1-9-7-12-10(15-8-9)11-3-4-14-6-5-13-2/h9H,3-8H2,1-2H3,(H,11,12)
InChIKeySBZCBXKFRRAGAS-UHFFFAOYSA-N
MW232.35 g/mol
LogP0.98
Rot. Bonds6

About N-[2-(2-methoxyethoxy)ethyl]-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine

N-[2-(2-methoxyethoxy)ethyl]-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine (PubChem CID 65036126) has the molecular formula C10H20N2O2S and a molecular weight of 232.35 g/mol. Its IUPAC name is N-[2-(2-methoxyethoxy)ethyl]-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine.

Molecular Properties

Compound NameN-[2-(2-methoxyethoxy)ethyl]-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine
PubChem CID65036126
Molecular FormulaC10H20N2O2S
Molecular Weight232.35 g/mol
Exact Mass232.12
IUPAC NameN-[2-(2-methoxyethoxy)ethyl]-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCOCCOCCNC1=NCC(C)CS1
InChIInChI=1S/C10H20N2O2S/c1-9-7-12-10(15-8-9)11-3-4-14-6-5-13-2/h9H,3-8H2,1-2H3,(H,11,12)
InChIKeySBZCBXKFRRAGAS-UHFFFAOYSA-N
XLogP0.98
TPSA42.85 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyethoxy)ethyl]-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine?
The IUPAC name of N-[2-(2-methoxyethoxy)ethyl]-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine (CID 65036126) is N-[2-(2-methoxyethoxy)ethyl]-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine.
What is the SMILES notation for N-[2-(2-methoxyethoxy)ethyl]-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine?
The canonical SMILES for N-[2-(2-methoxyethoxy)ethyl]-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine is COCCOCCNC1=NCC(C)CS1.
What is the InChIKey of N-[2-(2-methoxyethoxy)ethyl]-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine?
The InChIKey is SBZCBXKFRRAGAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2S/c1-9-7-12-10(15-8-9)11-3-4-14-6-5-13-2/h9H,3-8H2,1-2H3,(H,11,12).
What are the key properties of N-[2-(2-methoxyethoxy)ethyl]-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine?
N-[2-(2-methoxyethoxy)ethyl]-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine has a molecular weight of 232.35 g/mol, XLogP of 0.98, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyethoxy)ethyl]-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine is sourced from PubChem (CID 65036126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).