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

C9H17N3OS — CID 83018605

IUPACN-(5-methyl-5,6-dihydro-4H-1,3-thiazin-2-yl)morpholin-4-amine
SMILESCC1CN=C(NN2CCOCC2)SC1
InChIInChI=1S/C9H17N3OS/c1-8-6-10-9(14-7-8)11-12-2-4-13-5-3-12/h8H,2-7H2,1H3,(H,10,11)
InChIKeyPNOVRKVNJPDLHB-UHFFFAOYSA-N
MW215.32 g/mol
LogP0.56
Rot. Bonds1

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

N-(5-methyl-5,6-dihydro-4H-1,3-thiazin-2-yl)morpholin-4-amine (PubChem CID 83018605) has the molecular formula C9H17N3OS and a molecular weight of 215.32 g/mol. Its IUPAC name is N-(5-methyl-5,6-dihydro-4H-1,3-thiazin-2-yl)morpholin-4-amine.

Molecular Properties

Compound NameN-(5-methyl-5,6-dihydro-4H-1,3-thiazin-2-yl)morpholin-4-amine
PubChem CID83018605
Molecular FormulaC9H17N3OS
Molecular Weight215.32 g/mol
Exact Mass215.11
IUPAC NameN-(5-methyl-5,6-dihydro-4H-1,3-thiazin-2-yl)morpholin-4-amine
SMILESCC1CN=C(NN2CCOCC2)SC1
InChIInChI=1S/C9H17N3OS/c1-8-6-10-9(14-7-8)11-12-2-4-13-5-3-12/h8H,2-7H2,1H3,(H,10,11)
InChIKeyPNOVRKVNJPDLHB-UHFFFAOYSA-N
XLogP0.56
TPSA36.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.32
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-5,6-dihydro-4H-1,3-thiazin-2-yl)morpholin-4-amine?
The IUPAC name of N-(5-methyl-5,6-dihydro-4H-1,3-thiazin-2-yl)morpholin-4-amine (CID 83018605) is N-(5-methyl-5,6-dihydro-4H-1,3-thiazin-2-yl)morpholin-4-amine.
What is the SMILES notation for N-(5-methyl-5,6-dihydro-4H-1,3-thiazin-2-yl)morpholin-4-amine?
The canonical SMILES for N-(5-methyl-5,6-dihydro-4H-1,3-thiazin-2-yl)morpholin-4-amine is CC1CN=C(NN2CCOCC2)SC1.
What is the InChIKey of N-(5-methyl-5,6-dihydro-4H-1,3-thiazin-2-yl)morpholin-4-amine?
The InChIKey is PNOVRKVNJPDLHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N3OS/c1-8-6-10-9(14-7-8)11-12-2-4-13-5-3-12/h8H,2-7H2,1H3,(H,10,11).
What are the key properties of N-(5-methyl-5,6-dihydro-4H-1,3-thiazin-2-yl)morpholin-4-amine?
N-(5-methyl-5,6-dihydro-4H-1,3-thiazin-2-yl)morpholin-4-amine has a molecular weight of 215.32 g/mol, XLogP of 0.56, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-5,6-dihydro-4H-1,3-thiazin-2-yl)morpholin-4-amine is sourced from PubChem (CID 83018605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).