6-(dimethylamino)-2-(2-pyridin-2-ylethyl)-[1,2]thiazolo[5,4-d]pyrimidin-3-one

C14H15N5OS — CID 23287888

IUPAC6-(dimethylamino)-2-(2-pyridin-2-ylethyl)-[1,2]thiazolo[5,4-d]pyrimidin-3-one
SMILESCN(C)c1ncc2c(=O)n(CCc3ccccn3)sc2n1
InChIInChI=1S/C14H15N5OS/c1-18(2)14-16-9-11-12(17-14)21-19(13(11)20)8-6-10-5-3-4-7-15-10/h3-5,7,9H,6,8H2,1-2H3
InChIKeyHKRQVXYFOWWFGS-UHFFFAOYSA-N
MW301.38 g/mol
LogP1.56
Rot. Bonds4

About 6-(dimethylamino)-2-(2-pyridin-2-ylethyl)-[1,2]thiazolo[5,4-d]pyrimidin-3-one

6-(dimethylamino)-2-(2-pyridin-2-ylethyl)-[1,2]thiazolo[5,4-d]pyrimidin-3-one (PubChem CID 23287888) has the molecular formula C14H15N5OS and a molecular weight of 301.38 g/mol. Its IUPAC name is 6-(dimethylamino)-2-(2-pyridin-2-ylethyl)-[1,2]thiazolo[5,4-d]pyrimidin-3-one.

Molecular Properties

Compound Name6-(dimethylamino)-2-(2-pyridin-2-ylethyl)-[1,2]thiazolo[5,4-d]pyrimidin-3-one
PubChem CID23287888
Molecular FormulaC14H15N5OS
Molecular Weight301.38 g/mol
Exact Mass301.10
IUPAC Name6-(dimethylamino)-2-(2-pyridin-2-ylethyl)-[1,2]thiazolo[5,4-d]pyrimidin-3-one
SMILESCN(C)c1ncc2c(=O)n(CCc3ccccn3)sc2n1
InChIInChI=1S/C14H15N5OS/c1-18(2)14-16-9-11-12(17-14)21-19(13(11)20)8-6-10-5-3-4-7-15-10/h3-5,7,9H,6,8H2,1-2H3
InChIKeyHKRQVXYFOWWFGS-UHFFFAOYSA-N
XLogP1.56
TPSA63.91 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.38
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

6-phenyl-2-(pyridin-2-ylmethyl)-[1,2]thiazolo[5,4-d]pyrimidin-3-one
CID 23287901
N,N-dimethyl-5-[1-(2-pyridin-2-ylethyl)imidazol-2-yl]pyrimidin-2-amine
CID 56870823
3-methyl-2-[[methyl(2-pyridin-2-ylethyl)amino]methyl]quinazolin-4-one
CID 122133317
2-butyl-[1,2]thiazolo[5,4-b]pyridin-3-one
CID 5271647
9-[3-(dimethylamino)-1,2,4-thiadiazol-5-yl]-2-(2-pyridin-2-ylethyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 72860013
1-(2-pyridin-2-ylethyl)pyridin-2-one
CID 116618481
1-(2-pyridin-2-ylethyl)pyrrolidine-2,5-dione
CID 571854
1-(2-pyridin-2-ylethyl)pyrimidin-2-one
CID 116618349
N,N-dimethyl-5-[[methyl(pyridin-2-ylmethyl)amino]methyl]pyrimidin-2-amine
CID 75500442
2-N,2-N-dimethyl-4-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
CID 64829086
4,6-dimethyl-1-(2-pyridin-2-ylethyl)indole-2,3-dione
CID 61357169
1,7,9-trimethyl-3,5,12-tris(2-pyridin-2-ylethyl)-3,5,12-triazatetracyclo[5.3.1.12,6.04,9]dodecane
CID 10530041

Frequently Asked Questions

What is the IUPAC name of 6-(dimethylamino)-2-(2-pyridin-2-ylethyl)-[1,2]thiazolo[5,4-d]pyrimidin-3-one?
The IUPAC name of 6-(dimethylamino)-2-(2-pyridin-2-ylethyl)-[1,2]thiazolo[5,4-d]pyrimidin-3-one (CID 23287888) is 6-(dimethylamino)-2-(2-pyridin-2-ylethyl)-[1,2]thiazolo[5,4-d]pyrimidin-3-one.
What is the SMILES notation for 6-(dimethylamino)-2-(2-pyridin-2-ylethyl)-[1,2]thiazolo[5,4-d]pyrimidin-3-one?
The canonical SMILES for 6-(dimethylamino)-2-(2-pyridin-2-ylethyl)-[1,2]thiazolo[5,4-d]pyrimidin-3-one is CN(C)c1ncc2c(=O)n(CCc3ccccn3)sc2n1.
What is the InChIKey of 6-(dimethylamino)-2-(2-pyridin-2-ylethyl)-[1,2]thiazolo[5,4-d]pyrimidin-3-one?
The InChIKey is HKRQVXYFOWWFGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5OS/c1-18(2)14-16-9-11-12(17-14)21-19(13(11)20)8-6-10-5-3-4-7-15-10/h3-5,7,9H,6,8H2,1-2H3.
What are the key properties of 6-(dimethylamino)-2-(2-pyridin-2-ylethyl)-[1,2]thiazolo[5,4-d]pyrimidin-3-one?
6-(dimethylamino)-2-(2-pyridin-2-ylethyl)-[1,2]thiazolo[5,4-d]pyrimidin-3-one has a molecular weight of 301.38 g/mol, XLogP of 1.56, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(dimethylamino)-2-(2-pyridin-2-ylethyl)-[1,2]thiazolo[5,4-d]pyrimidin-3-one is sourced from PubChem (CID 23287888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).