5-(2-tert-butylpyrimidin-4-yl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine

C14H19N5S — CID 75512541

IUPAC5-(2-tert-butylpyrimidin-4-yl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine
SMILESCC(C)(C)c1nccc(N2CCc3nc(N)sc3C2)n1
InChIInChI=1S/C14H19N5S/c1-14(2,3)12-16-6-4-11(18-12)19-7-5-9-10(8-19)20-13(15)17-9/h4,6H,5,7-8H2,1-3H3,(H2,15,17)
InChIKeyIYVHBSHERUEQQT-UHFFFAOYSA-N
MW289.41 g/mol
LogP2.38
Rot. Bonds1

About 5-(2-tert-butylpyrimidin-4-yl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine

5-(2-tert-butylpyrimidin-4-yl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine (PubChem CID 75512541) has the molecular formula C14H19N5S and a molecular weight of 289.41 g/mol. Its IUPAC name is 5-(2-tert-butylpyrimidin-4-yl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine.

Molecular Properties

Compound Name5-(2-tert-butylpyrimidin-4-yl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine
PubChem CID75512541
Molecular FormulaC14H19N5S
Molecular Weight289.41 g/mol
Exact Mass289.14
IUPAC Name5-(2-tert-butylpyrimidin-4-yl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine
SMILESCC(C)(C)c1nccc(N2CCc3nc(N)sc3C2)n1
InChIInChI=1S/C14H19N5S/c1-14(2,3)12-16-6-4-11(18-12)19-7-5-9-10(8-19)20-13(15)17-9/h4,6H,5,7-8H2,1-3H3,(H2,15,17)
InChIKeyIYVHBSHERUEQQT-UHFFFAOYSA-N
XLogP2.38
TPSA67.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.41
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(2-tert-butylpyrimidin-4-yl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine?
The IUPAC name of 5-(2-tert-butylpyrimidin-4-yl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine (CID 75512541) is 5-(2-tert-butylpyrimidin-4-yl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine.
What is the SMILES notation for 5-(2-tert-butylpyrimidin-4-yl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine?
The canonical SMILES for 5-(2-tert-butylpyrimidin-4-yl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine is CC(C)(C)c1nccc(N2CCc3nc(N)sc3C2)n1.
What is the InChIKey of 5-(2-tert-butylpyrimidin-4-yl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine?
The InChIKey is IYVHBSHERUEQQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5S/c1-14(2,3)12-16-6-4-11(18-12)19-7-5-9-10(8-19)20-13(15)17-9/h4,6H,5,7-8H2,1-3H3,(H2,15,17).
What are the key properties of 5-(2-tert-butylpyrimidin-4-yl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine?
5-(2-tert-butylpyrimidin-4-yl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine has a molecular weight of 289.41 g/mol, XLogP of 2.38, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-tert-butylpyrimidin-4-yl)-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-amine is sourced from PubChem (CID 75512541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).