1-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)cyclobutan-1-amine

C9H10N4S — CID 131113925

IUPAC1-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)cyclobutan-1-amine
SMILESNC1(c2ncnc3scnc23)CCC1
InChIInChI=1S/C9H10N4S/c10-9(2-1-3-9)7-6-8(12-4-11-7)14-5-13-6/h4-5H,1-3,10H2
InChIKeyMDZPXGYUAQXFEF-UHFFFAOYSA-N
MW206.27 g/mol
LogP1.42
Rot. Bonds1

About 1-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)cyclobutan-1-amine

1-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)cyclobutan-1-amine (PubChem CID 131113925) has the molecular formula C9H10N4S and a molecular weight of 206.27 g/mol. Its IUPAC name is 1-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)cyclobutan-1-amine.

Molecular Properties

Compound Name1-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)cyclobutan-1-amine
PubChem CID131113925
Molecular FormulaC9H10N4S
Molecular Weight206.27 g/mol
Exact Mass206.06
IUPAC Name1-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)cyclobutan-1-amine
SMILESNC1(c2ncnc3scnc23)CCC1
InChIInChI=1S/C9H10N4S/c10-9(2-1-3-9)7-6-8(12-4-11-7)14-5-13-6/h4-5H,1-3,10H2
InChIKeyMDZPXGYUAQXFEF-UHFFFAOYSA-N
XLogP1.42
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

7-[4-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)-1,4-diazepan-1-yl]-[1,3]thiazolo[5,4-d]pyrimidine
CID 166243412
1-(5-chloropyrimidin-4-yl)cyclohexan-1-amine
CID 130545305
N-cyclopropyl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine
CID 130698432
1-(5-methyl-1H-imidazol-2-yl)cyclobutan-1-amine
CID 96733863
1-(5-methylpyrimidin-2-yl)cyclobutan-1-amine
CID 130545603
8-methyl-6-([1,3]thiazolo[5,4-d]pyrimidin-7-ylamino)spiro[2H-imidazo[1,5-a]pyridine-3,1'-cyclobutane]-1,5-dione
CID 135259019
2-(methoxymethyl)-4-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)morpholine
CID 122154681
1-(5-chloro-3-fluoro-2-pyridinyl)cyclopentan-1-amine
CID 130545352
1-(5-bromo-3-chloro-2-pyridinyl)cyclopentan-1-amine
CID 130545363
6,7-dimethyl-[1,3]thiazolo[5,4-b]pyridine;ethane
CID 144514698
1-[3-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-5-yl]cyclobutan-1-amine
CID 81162188
1-(7-chloroquinazolin-4-yl)cyclopropan-1-amine
CID 105475082

Frequently Asked Questions

What is the IUPAC name of 1-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)cyclobutan-1-amine?
The IUPAC name of 1-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)cyclobutan-1-amine (CID 131113925) is 1-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)cyclobutan-1-amine.
What is the SMILES notation for 1-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)cyclobutan-1-amine?
The canonical SMILES for 1-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)cyclobutan-1-amine is NC1(c2ncnc3scnc23)CCC1.
What is the InChIKey of 1-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)cyclobutan-1-amine?
The InChIKey is MDZPXGYUAQXFEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4S/c10-9(2-1-3-9)7-6-8(12-4-11-7)14-5-13-6/h4-5H,1-3,10H2.
What are the key properties of 1-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)cyclobutan-1-amine?
1-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)cyclobutan-1-amine has a molecular weight of 206.27 g/mol, XLogP of 1.42, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-([1,3]thiazolo[5,4-d]pyrimidin-7-yl)cyclobutan-1-amine is sourced from PubChem (CID 131113925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).