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

C6H11N3OS — CID 29068059

IUPAC2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)acetamide
SMILESNC(=O)CNC1=NCCCS1
InChIInChI=1S/C6H11N3OS/c7-5(10)4-9-6-8-2-1-3-11-6/h1-4H2,(H2,7,10)(H,8,9)
InChIKeyNJWHWZPWAUXUPE-UHFFFAOYSA-N
MW173.24 g/mol
LogP-0.45
Rot. Bonds2

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

2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)acetamide (PubChem CID 29068059) has the molecular formula C6H11N3OS and a molecular weight of 173.24 g/mol. Its IUPAC name is 2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)acetamide.

Molecular Properties

Compound Name2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)acetamide
PubChem CID29068059
Molecular FormulaC6H11N3OS
Molecular Weight173.24 g/mol
Exact Mass173.06
IUPAC Name2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)acetamide
SMILESNC(=O)CNC1=NCCCS1
InChIInChI=1S/C6H11N3OS/c7-5(10)4-9-6-8-2-1-3-11-6/h1-4H2,(H2,7,10)(H,8,9)
InChIKeyNJWHWZPWAUXUPE-UHFFFAOYSA-N
XLogP-0.45
TPSA67.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.24
LogP ≤ 5-0.45
H-Bond Donors ≤ 52
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)acetamide?
The IUPAC name of 2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)acetamide (CID 29068059) is 2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)acetamide.
What is the SMILES notation for 2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)acetamide?
The canonical SMILES for 2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)acetamide is NC(=O)CNC1=NCCCS1.
What is the InChIKey of 2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)acetamide?
The InChIKey is NJWHWZPWAUXUPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3OS/c7-5(10)4-9-6-8-2-1-3-11-6/h1-4H2,(H2,7,10)(H,8,9).
What are the key properties of 2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)acetamide?
2-(5,6-dihydro-4H-1,3-thiazin-2-ylamino)acetamide has a molecular weight of 173.24 g/mol, XLogP of -0.45, 2 rotatable bonds, 2 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)acetamide is sourced from PubChem (CID 29068059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).