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

C12H22N2OS — CID 63827036

IUPACN-(2-cyclohexyloxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESC1CCC(OCCNC2=NCCCS2)CC1
InChIInChI=1S/C12H22N2OS/c1-2-5-11(6-3-1)15-9-8-14-12-13-7-4-10-16-12/h11H,1-10H2,(H,13,14)
InChIKeyWYQILHGDXJCHRF-UHFFFAOYSA-N
MW242.39 g/mol
LogP2.42
Rot. Bonds4

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

N-(2-cyclohexyloxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine (PubChem CID 63827036) has the molecular formula C12H22N2OS and a molecular weight of 242.39 g/mol. Its IUPAC name is N-(2-cyclohexyloxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine.

Molecular Properties

Compound NameN-(2-cyclohexyloxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
PubChem CID63827036
Molecular FormulaC12H22N2OS
Molecular Weight242.39 g/mol
Exact Mass242.15
IUPAC NameN-(2-cyclohexyloxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESC1CCC(OCCNC2=NCCCS2)CC1
InChIInChI=1S/C12H22N2OS/c1-2-5-11(6-3-1)15-9-8-14-12-13-7-4-10-16-12/h11H,1-10H2,(H,13,14)
InChIKeyWYQILHGDXJCHRF-UHFFFAOYSA-N
XLogP2.42
TPSA33.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.39
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(oxan-2-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 61611926
N-(oxan-2-ylmethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 61611927
5-methyl-N-(oxan-2-ylmethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 61611953
N-(2-butoxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 61882195
N-(2-cyclohexyloxyethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63826686
N-(2-cyclohexyloxyethyl)-5-methyl-4,5-dihydro-1,3-thiazol-2-amine
CID 63826687
N-(2-cyclohexyloxyethyl)-5-cyclopropyl-4,5-dihydro-1,3-thiazol-2-amine
CID 63827392
N-(2-cyclopentyloxyethyl)-4,5-dihydro-1,3-thiazol-2-amine
CID 63828631
N-(2-cyclopentyloxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 63828809
N-(2-cyclopentyloxyethyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 65035433
N-(2-cyclohexyloxyethyl)-5-methyl-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 65035434
5-methyl-N-(oxan-2-ylmethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine
CID 65035707

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexyloxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The IUPAC name of N-(2-cyclohexyloxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine (CID 63827036) is N-(2-cyclohexyloxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine.
What is the SMILES notation for N-(2-cyclohexyloxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The canonical SMILES for N-(2-cyclohexyloxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine is C1CCC(OCCNC2=NCCCS2)CC1.
What is the InChIKey of N-(2-cyclohexyloxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
The InChIKey is WYQILHGDXJCHRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2OS/c1-2-5-11(6-3-1)15-9-8-14-12-13-7-4-10-16-12/h11H,1-10H2,(H,13,14).
What are the key properties of N-(2-cyclohexyloxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine?
N-(2-cyclohexyloxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine has a molecular weight of 242.39 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexyloxyethyl)-5,6-dihydro-4H-1,3-thiazin-2-amine is sourced from PubChem (CID 63827036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).