2-cyclopropyl-[1,3]thiazolo[4,5-d]pyrimidine

C8H7N3S — CID 141192936

IUPAC2-cyclopropyl-[1,3]thiazolo[4,5-d]pyrimidine
SMILESc1ncc2sc(C3CC3)nc2n1
InChIInChI=1S/C8H7N3S/c1-2-5(1)8-11-7-6(12-8)3-9-4-10-7/h3-5H,1-2H2
InChIKeyHYWDLEXILNDFAP-UHFFFAOYSA-N
MW177.23 g/mol
LogP1.96
Rot. Bonds1

About 2-cyclopropyl-[1,3]thiazolo[4,5-d]pyrimidine

2-cyclopropyl-[1,3]thiazolo[4,5-d]pyrimidine (PubChem CID 141192936) has the molecular formula C8H7N3S and a molecular weight of 177.23 g/mol. Its IUPAC name is 2-cyclopropyl-[1,3]thiazolo[4,5-d]pyrimidine.

Molecular Properties

Compound Name2-cyclopropyl-[1,3]thiazolo[4,5-d]pyrimidine
PubChem CID141192936
Molecular FormulaC8H7N3S
Molecular Weight177.23 g/mol
Exact Mass177.04
IUPAC Name2-cyclopropyl-[1,3]thiazolo[4,5-d]pyrimidine
SMILESc1ncc2sc(C3CC3)nc2n1
InChIInChI=1S/C8H7N3S/c1-2-5(1)8-11-7-6(12-8)3-9-4-10-7/h3-5H,1-2H2
InChIKeyHYWDLEXILNDFAP-UHFFFAOYSA-N
XLogP1.96
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.23
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyclopropyl-6-ethenyl-[1,3]thiazolo[4,5-b]pyridine
CID 138718793
2-cyclohexyl-[1,3]thiazolo[4,5-b]pyridine
CID 139087737
4-([1,3]thiazolo[4,5-d]pyrimidin-2-yl)morpholine
CID 123685077
7-cyclopropylthieno[3,2-d]pyrimidine
CID 174703681
6-cyclohexyl-[1,3]thiazolo[4,5-c]pyridazine
CID 169285097
methyl 2-cyclopropyl-[1,3]thiazolo[4,5-b]pyridine-5-carboxylate
CID 118644349
2-cyclodecyl-5-cyclooctylthieno[2,3-d][1,3]thiazole
CID 166923022
2-cyclopropyl-5-iodo-1,3-thiazole
CID 126976994
8-(4-cyclopropylphenyl)-7H-purine
CID 167906113
6-piperidin-4-ylthieno[2,3-d]pyrimidine
CID 96608942
(2-cyclopropyl-4H-pyrrolo[2,3-d][1,3]thiazol-5-yl)methanediol
CID 167209630
8-[4-(trifluoromethyl)cyclohexyl]-7H-purine
CID 114402527

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-[1,3]thiazolo[4,5-d]pyrimidine?
The IUPAC name of 2-cyclopropyl-[1,3]thiazolo[4,5-d]pyrimidine (CID 141192936) is 2-cyclopropyl-[1,3]thiazolo[4,5-d]pyrimidine.
What is the SMILES notation for 2-cyclopropyl-[1,3]thiazolo[4,5-d]pyrimidine?
The canonical SMILES for 2-cyclopropyl-[1,3]thiazolo[4,5-d]pyrimidine is c1ncc2sc(C3CC3)nc2n1.
What is the InChIKey of 2-cyclopropyl-[1,3]thiazolo[4,5-d]pyrimidine?
The InChIKey is HYWDLEXILNDFAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3S/c1-2-5(1)8-11-7-6(12-8)3-9-4-10-7/h3-5H,1-2H2.
What are the key properties of 2-cyclopropyl-[1,3]thiazolo[4,5-d]pyrimidine?
2-cyclopropyl-[1,3]thiazolo[4,5-d]pyrimidine has a molecular weight of 177.23 g/mol, XLogP of 1.96, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-[1,3]thiazolo[4,5-d]pyrimidine is sourced from PubChem (CID 141192936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).