8-methyl-2H-pyrimido[2,1-b][1,3]thiazin-6-one

C8H8N2OS — CID 19001813

IUPAC8-methyl-2H-pyrimido[2,1-b][1,3]thiazin-6-one
SMILESCc1cc(=O)n2c(n1)SCC=C2
InChIInChI=1S/C8H8N2OS/c1-6-5-7(11)10-3-2-4-12-8(10)9-6/h2-3,5H,4H2,1H3
InChIKeyKDLTYKUHEDMZDJ-UHFFFAOYSA-N
MW180.23 g/mol
LogP1.13
Rot. Bonds

About 8-methyl-2H-pyrimido[2,1-b][1,3]thiazin-6-one

8-methyl-2H-pyrimido[2,1-b][1,3]thiazin-6-one (PubChem CID 19001813) has the molecular formula C8H8N2OS and a molecular weight of 180.23 g/mol. Its IUPAC name is 8-methyl-2H-pyrimido[2,1-b][1,3]thiazin-6-one.

Molecular Properties

Compound Name8-methyl-2H-pyrimido[2,1-b][1,3]thiazin-6-one
PubChem CID19001813
Molecular FormulaC8H8N2OS
Molecular Weight180.23 g/mol
Exact Mass180.04
IUPAC Name8-methyl-2H-pyrimido[2,1-b][1,3]thiazin-6-one
SMILESCc1cc(=O)n2c(n1)SCC=C2
InChIInChI=1S/C8H8N2OS/c1-6-5-7(11)10-3-2-4-12-8(10)9-6/h2-3,5H,4H2,1H3
InChIKeyKDLTYKUHEDMZDJ-UHFFFAOYSA-N
XLogP1.13
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.23
LogP ≤ 51.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

7-Methyl-5H-(1,3)thiazolo(3,2-a)pyrimidin-5-one
CID 597065
2-(4-Methyl-6-oxo-1-prop-2-enylpyrimidin-2-yl)sulfanylacetamide
CID 974720
4(3H)-Pyrimidinone, 3,6-dimethyl-2-(methylthio)-
CID 12295356
8-methyl-2H,3H,4H,6H-pyrimido[2,1-b][1,3]thiazin-6-one
CID 3900641
7-[(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)methyl]-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 6468090
(5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl N,N-diethylcarbamodithioate
CID 8891253
2-(Ethylthio)-3-methyl-4-pyrimidone
CID 129660839
Pyrimido[2,1-b][1,3]thiazin-6-one
CID 18919072
2,7-Dimethyl-5h-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 22434125
2-(allylsulfanyl)-3-methyl-6-(trifluoromethyl)-4(3H)-pyrimidinone
CID 3692241
5-methyl-7H-[1,2-a]pyrimidin-7-one
CID 54613743
7-Ethyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 67796434

Frequently Asked Questions

What is the IUPAC name of 8-methyl-2H-pyrimido[2,1-b][1,3]thiazin-6-one?
The IUPAC name of 8-methyl-2H-pyrimido[2,1-b][1,3]thiazin-6-one (CID 19001813) is 8-methyl-2H-pyrimido[2,1-b][1,3]thiazin-6-one.
What is the SMILES notation for 8-methyl-2H-pyrimido[2,1-b][1,3]thiazin-6-one?
The canonical SMILES for 8-methyl-2H-pyrimido[2,1-b][1,3]thiazin-6-one is Cc1cc(=O)n2c(n1)SCC=C2.
What is the InChIKey of 8-methyl-2H-pyrimido[2,1-b][1,3]thiazin-6-one?
The InChIKey is KDLTYKUHEDMZDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2OS/c1-6-5-7(11)10-3-2-4-12-8(10)9-6/h2-3,5H,4H2,1H3.
What are the key properties of 8-methyl-2H-pyrimido[2,1-b][1,3]thiazin-6-one?
8-methyl-2H-pyrimido[2,1-b][1,3]thiazin-6-one has a molecular weight of 180.23 g/mol, XLogP of 1.13, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-2H-pyrimido[2,1-b][1,3]thiazin-6-one is sourced from PubChem (CID 19001813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).