N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N-(3-methoxyphenyl)acetamide

C13H16N2O2S — CID 1431142

IUPACN-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(N(C(C)=O)C2=NCCCS2)c1
InChIInChI=1S/C13H16N2O2S/c1-10(16)15(13-14-7-4-8-18-13)11-5-3-6-12(9-11)17-2/h3,5-6,9H,4,7-8H2,1-2H3
InChIKeyAOAUVMBBVWKSKR-UHFFFAOYSA-N
MW264.35 g/mol
LogP2.54
Rot. Bonds2

About N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N-(3-methoxyphenyl)acetamide

N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N-(3-methoxyphenyl)acetamide (PubChem CID 1431142) has the molecular formula C13H16N2O2S and a molecular weight of 264.35 g/mol. Its IUPAC name is N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N-(3-methoxyphenyl)acetamide
PubChem CID1431142
Molecular FormulaC13H16N2O2S
Molecular Weight264.35 g/mol
Exact Mass264.09
IUPAC NameN-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(N(C(C)=O)C2=NCCCS2)c1
InChIInChI=1S/C13H16N2O2S/c1-10(16)15(13-14-7-4-8-18-13)11-5-3-6-12(9-11)17-2/h3,5-6,9H,4,7-8H2,1-2H3
InChIKeyAOAUVMBBVWKSKR-UHFFFAOYSA-N
XLogP2.54
TPSA41.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.35
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N-(3-methoxyphenyl)acetamide?
The IUPAC name of N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N-(3-methoxyphenyl)acetamide (CID 1431142) is N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N-(3-methoxyphenyl)acetamide is COc1cccc(N(C(C)=O)C2=NCCCS2)c1.
What is the InChIKey of N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N-(3-methoxyphenyl)acetamide?
The InChIKey is AOAUVMBBVWKSKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2S/c1-10(16)15(13-14-7-4-8-18-13)11-5-3-6-12(9-11)17-2/h3,5-6,9H,4,7-8H2,1-2H3.
What are the key properties of N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N-(3-methoxyphenyl)acetamide?
N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N-(3-methoxyphenyl)acetamide has a molecular weight of 264.35 g/mol, XLogP of 2.54, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5,6-dihydro-4H-1,3-thiazin-2-yl)-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 1431142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).