2-pyridin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine

C10H7N5S — CID 53322563

IUPAC2-pyridin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine
SMILESNc1ncnc2sc(-c3ccncc3)nc12
InChIInChI=1S/C10H7N5S/c11-8-7-10(14-5-13-8)16-9(15-7)6-1-3-12-4-2-6/h1-5H,(H2,11,13,14)
InChIKeyCXVHESBKNGKION-UHFFFAOYSA-N
MW229.27 g/mol
LogP1.73
Rot. Bonds1

About 2-pyridin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine

2-pyridin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine (PubChem CID 53322563) has the molecular formula C10H7N5S and a molecular weight of 229.27 g/mol. Its IUPAC name is 2-pyridin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine.

Molecular Properties

Compound Name2-pyridin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine
PubChem CID53322563
Molecular FormulaC10H7N5S
Molecular Weight229.27 g/mol
Exact Mass229.04
IUPAC Name2-pyridin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine
SMILESNc1ncnc2sc(-c3ccncc3)nc12
InChIInChI=1S/C10H7N5S/c11-8-7-10(14-5-13-8)16-9(15-7)6-1-3-12-4-2-6/h1-5H,(H2,11,13,14)
InChIKeyCXVHESBKNGKION-UHFFFAOYSA-N
XLogP1.73
TPSA77.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.27
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-pyridin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine?
The IUPAC name of 2-pyridin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine (CID 53322563) is 2-pyridin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine.
What is the SMILES notation for 2-pyridin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine?
The canonical SMILES for 2-pyridin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine is Nc1ncnc2sc(-c3ccncc3)nc12.
What is the InChIKey of 2-pyridin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine?
The InChIKey is CXVHESBKNGKION-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N5S/c11-8-7-10(14-5-13-8)16-9(15-7)6-1-3-12-4-2-6/h1-5H,(H2,11,13,14).
What are the key properties of 2-pyridin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine?
2-pyridin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine has a molecular weight of 229.27 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-4-yl-[1,3]thiazolo[5,4-d]pyrimidin-7-amine is sourced from PubChem (CID 53322563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).