6-methyl-2-piperidin-1-yl-4H-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione

C11H14N4O2S — CID 95928455

IUPAC6-methyl-2-piperidin-1-yl-4H-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione
SMILESCn1c(=O)[nH]c2nc(N3CCCCC3)sc2c1=O
InChIInChI=1S/C11H14N4O2S/c1-14-9(16)7-8(12-10(14)17)13-11(18-7)15-5-3-2-4-6-15/h2-6H2,1H3,(H,12,17)
InChIKeyWVTXTTJXNWEVQY-UHFFFAOYSA-N
MW266.33 g/mol
LogP0.67
Rot. Bonds1

About 6-methyl-2-piperidin-1-yl-4H-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione

6-methyl-2-piperidin-1-yl-4H-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione (PubChem CID 95928455) has the molecular formula C11H14N4O2S and a molecular weight of 266.33 g/mol. Its IUPAC name is 6-methyl-2-piperidin-1-yl-4H-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione.

Molecular Properties

Compound Name6-methyl-2-piperidin-1-yl-4H-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione
PubChem CID95928455
Molecular FormulaC11H14N4O2S
Molecular Weight266.33 g/mol
Exact Mass266.08
IUPAC Name6-methyl-2-piperidin-1-yl-4H-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione
SMILESCn1c(=O)[nH]c2nc(N3CCCCC3)sc2c1=O
InChIInChI=1S/C11H14N4O2S/c1-14-9(16)7-8(12-10(14)17)13-11(18-7)15-5-3-2-4-6-15/h2-6H2,1H3,(H,12,17)
InChIKeyWVTXTTJXNWEVQY-UHFFFAOYSA-N
XLogP0.67
TPSA70.99 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 50.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-methyl-2-piperidin-1-yl-4H-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione 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

1-methyl-8-pyrrolidin-1-yl-3,7-dihydropurine-2,6-dione
CID 167861908
2,6-di(piperidin-1-yl)-1,3,5-thiadiazin-4-one
CID 15063235
2-(4-methylpiperidin-1-yl)-6-propan-2-yl-5-sulfanylidene-4H-[1,3]thiazolo[4,5-d]pyrimidin-7-one
CID 50743625
N-methyl-5-[4-[(6-methyl-5,7-dioxo-4H-[1,3]thiazolo[4,5-d]pyrimidin-2-yl)methyl]piperazin-1-yl]pyridine-2-carboxamide
CID 170981093
7-bromo-3-methyl-2-piperidin-1-ylthieno[3,2-d]pyrimidin-4-one
CID 169155375
11-(azepan-1-yl)-12-thia-3,4,6,8,10-pentazatricyclo[7.3.0.02,6]dodeca-1(9),2,7,10-tetraen-5-one
CID 95915870
2-(5,7-dioxo-2-piperidin-1-yl-6-propyl-[1,3]thiazolo[4,5-d]pyrimidin-4-yl)acetonitrile
CID 95917887
5-methyl-2-piperidin-1-yl-1,3-thiazol-4-amine
CID 83108734
2-(azepan-1-yl)-5-bromo-4-methyl-1,3-thiazole
CID 83558280
N-[(4-methyl-2-piperidin-1-yl-1,3-thiazol-5-yl)methyl]ethanamine
CID 46785724
methyl 2-(azocan-1-yl)-4-methyl-1,3-thiazole-5-carboxylate
CID 80570330
2-(azocan-1-yl)-5,6-dihydro-4H-1,3-benzothiazol-7-one
CID 62757458

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-piperidin-1-yl-4H-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione?
The IUPAC name of 6-methyl-2-piperidin-1-yl-4H-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione (CID 95928455) is 6-methyl-2-piperidin-1-yl-4H-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione.
What is the SMILES notation for 6-methyl-2-piperidin-1-yl-4H-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione?
The canonical SMILES for 6-methyl-2-piperidin-1-yl-4H-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione is Cn1c(=O)[nH]c2nc(N3CCCCC3)sc2c1=O.
What is the InChIKey of 6-methyl-2-piperidin-1-yl-4H-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione?
The InChIKey is WVTXTTJXNWEVQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O2S/c1-14-9(16)7-8(12-10(14)17)13-11(18-7)15-5-3-2-4-6-15/h2-6H2,1H3,(H,12,17).
What are the key properties of 6-methyl-2-piperidin-1-yl-4H-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione?
6-methyl-2-piperidin-1-yl-4H-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione has a molecular weight of 266.33 g/mol, XLogP of 0.67, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-piperidin-1-yl-4H-[1,3]thiazolo[4,5-d]pyrimidine-5,7-dione is sourced from PubChem (CID 95928455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).