N-(3-methoxy-2-methylpropyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine

C11H22N2OS — CID 115361495

IUPACN-(3-methoxy-2-methylpropyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine
SMILESCOCC(C)CNC1=NCC(C)(C)CS1
InChIInChI=1S/C11H22N2OS/c1-9(6-14-4)5-12-10-13-7-11(2,3)8-15-10/h9H,5-8H2,1-4H3,(H,12,13)
InChIKeyRCICRNAAYDFCIU-UHFFFAOYSA-N
MW230.38 g/mol
LogP1.99
Rot. Bonds4

About N-(3-methoxy-2-methylpropyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine

N-(3-methoxy-2-methylpropyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine (PubChem CID 115361495) has the molecular formula C11H22N2OS and a molecular weight of 230.38 g/mol. Its IUPAC name is N-(3-methoxy-2-methylpropyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine.

Molecular Properties

Compound NameN-(3-methoxy-2-methylpropyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine
PubChem CID115361495
Molecular FormulaC11H22N2OS
Molecular Weight230.38 g/mol
Exact Mass230.15
IUPAC NameN-(3-methoxy-2-methylpropyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine
SMILESCOCC(C)CNC1=NCC(C)(C)CS1
InChIInChI=1S/C11H22N2OS/c1-9(6-14-4)5-12-10-13-7-11(2,3)8-15-10/h9H,5-8H2,1-4H3,(H,12,13)
InChIKeyRCICRNAAYDFCIU-UHFFFAOYSA-N
XLogP1.99
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.38
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,2-difluoroethyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine
CID 115407841
5,5-dimethyl-N-(3-methylpentan-2-yl)-4,6-dihydro-1,3-thiazin-2-amine
CID 115361325
5,5-dimethyl-N-[(1-methylcyclopentyl)methyl]-4,6-dihydro-1,3-thiazin-2-amine
CID 115361640
N-(2-cyclopentyloxyethyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine
CID 115361644
N-[(4-ethylcyclohexyl)methyl]-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine
CID 115361472
N-hexyl-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine
CID 115361245
5,5-dimethyl-N-[(1-methylpyrazol-4-yl)methyl]-4,6-dihydro-1,3-thiazin-2-amine
CID 115361492
ethyl 3-[(5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-yl)amino]propanoate
CID 115361499
N-tert-butyl-3-[(5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-yl)amino]propanamide
CID 113410833
N-(1-methoxy-3-methylbutan-2-yl)-2-thia-4-azaspiro[5.5]undec-3-en-3-amine
CID 103967942
5,5-dimethyl-N-[2-(1-methylpyrazol-4-yl)ethyl]-4,6-dihydro-1,3-thiazin-2-amine
CID 115361810
3-[(5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-yl)amino]-3-methylbutanamide
CID 106097590

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxy-2-methylpropyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine?
The IUPAC name of N-(3-methoxy-2-methylpropyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine (CID 115361495) is N-(3-methoxy-2-methylpropyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine.
What is the SMILES notation for N-(3-methoxy-2-methylpropyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine?
The canonical SMILES for N-(3-methoxy-2-methylpropyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine is COCC(C)CNC1=NCC(C)(C)CS1.
What is the InChIKey of N-(3-methoxy-2-methylpropyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine?
The InChIKey is RCICRNAAYDFCIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2OS/c1-9(6-14-4)5-12-10-13-7-11(2,3)8-15-10/h9H,5-8H2,1-4H3,(H,12,13).
What are the key properties of N-(3-methoxy-2-methylpropyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine?
N-(3-methoxy-2-methylpropyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine has a molecular weight of 230.38 g/mol, XLogP of 1.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxy-2-methylpropyl)-5,5-dimethyl-4,6-dihydro-1,3-thiazin-2-amine is sourced from PubChem (CID 115361495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).