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

C10H19N3OS — CID 79071458

IUPACN-[(4-methylmorpholin-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCN1CCOC(CNC2=NCCCS2)C1
InChIInChI=1S/C10H19N3OS/c1-13-4-5-14-9(8-13)7-12-10-11-3-2-6-15-10/h9H,2-8H2,1H3,(H,11,12)
InChIKeyMDEJWQXNTAHNPA-UHFFFAOYSA-N
MW229.35 g/mol
LogP0.40
Rot. Bonds2

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

N-[(4-methylmorpholin-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine (PubChem CID 79071458) has the molecular formula C10H19N3OS and a molecular weight of 229.35 g/mol. Its IUPAC name is N-[(4-methylmorpholin-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine.

Molecular Properties

Compound NameN-[(4-methylmorpholin-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
PubChem CID79071458
Molecular FormulaC10H19N3OS
Molecular Weight229.35 g/mol
Exact Mass229.12
IUPAC NameN-[(4-methylmorpholin-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine
SMILESCN1CCOC(CNC2=NCCCS2)C1
InChIInChI=1S/C10H19N3OS/c1-13-4-5-14-9(8-13)7-12-10-11-3-2-6-15-10/h9H,2-8H2,1H3,(H,11,12)
InChIKeyMDEJWQXNTAHNPA-UHFFFAOYSA-N
XLogP0.40
TPSA36.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.35
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(4-methylmorpholin-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine?
The IUPAC name of N-[(4-methylmorpholin-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine (CID 79071458) is N-[(4-methylmorpholin-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine.
What is the SMILES notation for N-[(4-methylmorpholin-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine?
The canonical SMILES for N-[(4-methylmorpholin-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine is CN1CCOC(CNC2=NCCCS2)C1.
What is the InChIKey of N-[(4-methylmorpholin-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine?
The InChIKey is MDEJWQXNTAHNPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3OS/c1-13-4-5-14-9(8-13)7-12-10-11-3-2-6-15-10/h9H,2-8H2,1H3,(H,11,12).
What are the key properties of N-[(4-methylmorpholin-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine?
N-[(4-methylmorpholin-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine has a molecular weight of 229.35 g/mol, XLogP of 0.40, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methylmorpholin-2-yl)methyl]-5,6-dihydro-4H-1,3-thiazin-2-amine is sourced from PubChem (CID 79071458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).