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

C13H15N3O3S — CID 60956756

IUPAC6-[4-(hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESO=C(c1cnc2sccn2c1=O)N1CCC(CO)CC1
InChIInChI=1S/C13H15N3O3S/c17-8-9-1-3-15(4-2-9)11(18)10-7-14-13-16(12(10)19)5-6-20-13/h5-7,9,17H,1-4,8H2
InChIKeySLWFHQZORNCKJB-UHFFFAOYSA-N
MW293.35 g/mol
LogP0.60
Rot. Bonds2

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

6-[4-(hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one (PubChem CID 60956756) has the molecular formula C13H15N3O3S and a molecular weight of 293.35 g/mol. Its IUPAC name is 6-[4-(hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name6-[4-(hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
PubChem CID60956756
Molecular FormulaC13H15N3O3S
Molecular Weight293.35 g/mol
Exact Mass293.08
IUPAC Name6-[4-(hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one
SMILESO=C(c1cnc2sccn2c1=O)N1CCC(CO)CC1
InChIInChI=1S/C13H15N3O3S/c17-8-9-1-3-15(4-2-9)11(18)10-7-14-13-16(12(10)19)5-6-20-13/h5-7,9,17H,1-4,8H2
InChIKeySLWFHQZORNCKJB-UHFFFAOYSA-N
XLogP0.60
TPSA74.91 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 50.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-[4-(hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

CID 3591999
CID 3591999
CID 4293960
CID 4293960
CID 3591996
CID 3591996
CID 3591998
CID 3591998
CID 4293959
CID 4293959
CID 43170445
CID 43170445
CID 43393888
CID 43393888
CID 43393955
CID 43393955
CID 43415831
CID 43415831
CID 43416047
CID 43416047
CID 43421083
CID 43421083
CID 43422103
CID 43422103

Frequently Asked Questions

What is the IUPAC name of 6-[4-(hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The IUPAC name of 6-[4-(hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one (CID 60956756) is 6-[4-(hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one.
What is the SMILES notation for 6-[4-(hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The canonical SMILES for 6-[4-(hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one is O=C(c1cnc2sccn2c1=O)N1CCC(CO)CC1.
What is the InChIKey of 6-[4-(hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
The InChIKey is SLWFHQZORNCKJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3S/c17-8-9-1-3-15(4-2-9)11(18)10-7-14-13-16(12(10)19)5-6-20-13/h5-7,9,17H,1-4,8H2.
What are the key properties of 6-[4-(hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one?
6-[4-(hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one has a molecular weight of 293.35 g/mol, XLogP of 0.60, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(hydroxymethyl)piperidine-1-carbonyl]-[1,3]thiazolo[3,2-a]pyrimidin-5-one is sourced from PubChem (CID 60956756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).