2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)-N,N-dimethylacetamide

C8H15N3OS — CID 43311087

IUPAC2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNC1=NCCCS1
InChIInChI=1S/C8H15N3OS/c1-11(2)7(12)6-10-8-9-4-3-5-13-8/h3-6H2,1-2H3,(H,9,10)
InChIKeyZWBCFCQDDLOBQU-UHFFFAOYSA-N
MW201.29 g/mol
LogP0.16
Rot. Bonds2

About 2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)-N,N-dimethylacetamide

2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)-N,N-dimethylacetamide (PubChem CID 43311087) has the molecular formula C8H15N3OS and a molecular weight of 201.29 g/mol. Its IUPAC name is 2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)-N,N-dimethylacetamide.

Molecular Properties

Compound Name2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)-N,N-dimethylacetamide
PubChem CID43311087
Molecular FormulaC8H15N3OS
Molecular Weight201.29 g/mol
Exact Mass201.09
IUPAC Name2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)-N,N-dimethylacetamide
SMILESCN(C)C(=O)CNC1=NCCCS1
InChIInChI=1S/C8H15N3OS/c1-11(2)7(12)6-10-8-9-4-3-5-13-8/h3-6H2,1-2H3,(H,9,10)
InChIKeyZWBCFCQDDLOBQU-UHFFFAOYSA-N
XLogP0.16
TPSA44.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.29
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)-N,N-dimethylacetamide?
The IUPAC name of 2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)-N,N-dimethylacetamide (CID 43311087) is 2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)-N,N-dimethylacetamide.
What is the SMILES notation for 2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)-N,N-dimethylacetamide?
The canonical SMILES for 2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)-N,N-dimethylacetamide is CN(C)C(=O)CNC1=NCCCS1.
What is the InChIKey of 2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)-N,N-dimethylacetamide?
The InChIKey is ZWBCFCQDDLOBQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3OS/c1-11(2)7(12)6-10-8-9-4-3-5-13-8/h3-6H2,1-2H3,(H,9,10).
What are the key properties of 2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)-N,N-dimethylacetamide?
2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)-N,N-dimethylacetamide has a molecular weight of 201.29 g/mol, XLogP of 0.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)-N,N-dimethylacetamide is sourced from PubChem (CID 43311087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).