6-(4-hydroxypiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one

C12H13N3O3S — CID 43416047

IUPAC6-(4-hydroxypiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESO=C(c1cnc2sccn2c1=O)N1CCC(O)CC1
InChIInChI=1S/C12H13N3O3S/c16-8-1-3-14(4-2-8)10(17)9-7-13-12-15(11(9)18)5-6-19-12/h5-8,16H,1-4H2
InChIKeyYUWKCOOQXKIPIK-UHFFFAOYSA-N
MW279.32 g/mol
LogP0.35
Rot. Bonds1

About 6-(4-hydroxypiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one

6-(4-hydroxypiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one (PubChem CID 43416047) has the molecular formula C12H13N3O3S and a molecular weight of 279.32 g/mol. Its IUPAC name is 6-(4-hydroxypiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name6-(4-hydroxypiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
PubChem CID43416047
Molecular FormulaC12H13N3O3S
Molecular Weight279.32 g/mol
Exact Mass279.07
IUPAC Name6-(4-hydroxypiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESO=C(c1cnc2sccn2c1=O)N1CCC(O)CC1
InChIInChI=1S/C12H13N3O3S/c16-8-1-3-14(4-2-8)10(17)9-7-13-12-15(11(9)18)5-6-19-12/h5-8,16H,1-4H2
InChIKeyYUWKCOOQXKIPIK-UHFFFAOYSA-N
XLogP0.35
TPSA74.91 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.32
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-(3-Hydroxypyrrolidine-1-carbonyl)-7-methylsulfanyl-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 126471432
6-(Piperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 3591996
6-(3-Hydroxypiperidine-1-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 43393888
6-(4-Hydroxypiperidine-1-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 43393955
6-(3-Hydroxypiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 43415831
6-[2-(Hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 43421083
6-[3-(Hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 43422103
6-[4-(2-Methylpropoxy)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 53509115
6-(4-Ethoxypiperidine-1-carbonyl)-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 53512661
N-(2-hydroxypropyl)-N-methyl-5-oxo-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
CID 55060964
6-[4-(Hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
CID 60956756
N-(3-hydroxypropyl)-5-oxo-N-propan-2-yl-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
CID 61038659

Frequently Asked Questions

What is the IUPAC name of 6-(4-hydroxypiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The IUPAC name of 6-(4-hydroxypiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one (CID 43416047) is 6-(4-hydroxypiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one.
What is the SMILES notation for 6-(4-hydroxypiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The canonical SMILES for 6-(4-hydroxypiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one is O=C(c1cnc2sccn2c1=O)N1CCC(O)CC1.
What is the InChIKey of 6-(4-hydroxypiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The InChIKey is YUWKCOOQXKIPIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O3S/c16-8-1-3-14(4-2-8)10(17)9-7-13-12-15(11(9)18)5-6-19-12/h5-8,16H,1-4H2.
What are the key properties of 6-(4-hydroxypiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
6-(4-hydroxypiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one has a molecular weight of 279.32 g/mol, XLogP of 0.35, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-hydroxypiperidine-1-carbonyl)-[1,3]thiazolo[3,2-a]pyrimidin-5-one is sourced from PubChem (CID 43416047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).