5-(diethylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one

C10H13N3OS — CID 3064609

IUPAC5-(diethylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one
SMILESCCN(CC)c1cc(=O)nc2sccn12
InChIInChI=1S/C10H13N3OS/c1-3-12(4-2)9-7-8(14)11-10-13(9)5-6-15-10/h5-7H,3-4H2,1-2H3
InChIKeyJNMFADVDIFMSGX-UHFFFAOYSA-N
MW223.30 g/mol
LogP1.60
Rot. Bonds3

About 5-(diethylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one

5-(diethylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one (PubChem CID 3064609) has the molecular formula C10H13N3OS and a molecular weight of 223.30 g/mol. Its IUPAC name is 5-(diethylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one.

Molecular Properties

Compound Name5-(diethylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one
PubChem CID3064609
Molecular FormulaC10H13N3OS
Molecular Weight223.30 g/mol
Exact Mass223.08
IUPAC Name5-(diethylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one
SMILESCCN(CC)c1cc(=O)nc2sccn12
InChIInChI=1S/C10H13N3OS/c1-3-12(4-2)9-7-8(14)11-10-13(9)5-6-15-10/h5-7H,3-4H2,1-2H3
InChIKeyJNMFADVDIFMSGX-UHFFFAOYSA-N
XLogP1.60
TPSA37.61 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.30
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

7H-Thiazolo(3,2-a)pyrimidin-7-one, 5-(1-pyrrolidinyl)-
CID 3064610
7H-Thiazolo(3,2-a)pyrimidin-7-one
CID 21852852
5-amino-7H-[1,3]thiazolo[3,2-a]pyrimidin-7-one
CID 146050234
7-(Methylthio)-5H-thiazolo[3,2-a]pyrimidin-5-one
CID 14319839
1-Methyl-2-(ethylthio)-4-pyrimidone
CID 85930388
5-(2,2-Dimethylpropylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one
CID 11806672
8-Ethyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-8-ium-7-olate
CID 13463958
5-Isocyano-[1,3]thiazolo[3,2-a]pyrimidin-7-one
CID 21780149
5-Oxo-8-propyl-[1,3]thiazolo[3,2-a]pyrimidin-8-ium-7-olate
CID 21791433
(E)-3-methylsulfanyl-N-(3-methyl-1,3-thiazol-2-ylidene)prop-2-enamide
CID 131235703

Frequently Asked Questions

What is the IUPAC name of 5-(diethylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one?
The IUPAC name of 5-(diethylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one (CID 3064609) is 5-(diethylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one.
What is the SMILES notation for 5-(diethylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one?
The canonical SMILES for 5-(diethylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one is CCN(CC)c1cc(=O)nc2sccn12.
What is the InChIKey of 5-(diethylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one?
The InChIKey is JNMFADVDIFMSGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3OS/c1-3-12(4-2)9-7-8(14)11-10-13(9)5-6-15-10/h5-7H,3-4H2,1-2H3.
What are the key properties of 5-(diethylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one?
5-(diethylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one has a molecular weight of 223.30 g/mol, XLogP of 1.60, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(diethylamino)-[1,3]thiazolo[3,2-a]pyrimidin-7-one is sourced from PubChem (CID 3064609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).