N-(1-methoxypropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine

C8H16N2OS — CID 43148945

IUPACN-(1-methoxypropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCOCC(C)NC1=NCCCS1
InChIInChI=1S/C8H16N2OS/c1-7(6-11-2)10-8-9-4-3-5-12-8/h7H,3-6H2,1-2H3,(H,9,10)
InChIKeyHNELHTYBQSUYOB-UHFFFAOYSA-N
MW188.30 g/mol
LogP1.10
Rot. Bonds3

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

N-(1-methoxypropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine (PubChem CID 43148945) has the molecular formula C8H16N2OS and a molecular weight of 188.30 g/mol. Its IUPAC name is N-(1-methoxypropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine.

Molecular Properties

Compound NameN-(1-methoxypropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine
PubChem CID43148945
Molecular FormulaC8H16N2OS
Molecular Weight188.30 g/mol
Exact Mass188.10
IUPAC NameN-(1-methoxypropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCOCC(C)NC1=NCCCS1
InChIInChI=1S/C8H16N2OS/c1-7(6-11-2)10-8-9-4-3-5-12-8/h7H,3-6H2,1-2H3,(H,9,10)
InChIKeyHNELHTYBQSUYOB-UHFFFAOYSA-N
XLogP1.10
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.30
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(1-methoxypropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The IUPAC name of N-(1-methoxypropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine (CID 43148945) is N-(1-methoxypropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine.
What is the SMILES notation for N-(1-methoxypropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The canonical SMILES for N-(1-methoxypropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine is COCC(C)NC1=NCCCS1.
What is the InChIKey of N-(1-methoxypropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The InChIKey is HNELHTYBQSUYOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2OS/c1-7(6-11-2)10-8-9-4-3-5-12-8/h7H,3-6H2,1-2H3,(H,9,10).
What are the key properties of N-(1-methoxypropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
N-(1-methoxypropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine has a molecular weight of 188.30 g/mol, XLogP of 1.10, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methoxypropan-2-yl)-5,6-dihydro-4H-1,3-thiazin-2-amine is sourced from PubChem (CID 43148945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).