3-(2-methylthieno[3,2-d]pyrimidin-4-yl)pyridin-4-amine

C12H10N4S — CID 157015350

IUPAC3-(2-methylthieno[3,2-d]pyrimidin-4-yl)pyridin-4-amine
SMILESCc1nc(-c2cnccc2N)c2sccc2n1
InChIInChI=1S/C12H10N4S/c1-7-15-10-3-5-17-12(10)11(16-7)8-6-14-4-2-9(8)13/h2-6H,1H3,(H2,13,14)
InChIKeyZSNDXANHBUHBBZ-UHFFFAOYSA-N
MW242.31 g/mol
LogP2.64
Rot. Bonds1

About 3-(2-methylthieno[3,2-d]pyrimidin-4-yl)pyridin-4-amine

3-(2-methylthieno[3,2-d]pyrimidin-4-yl)pyridin-4-amine (PubChem CID 157015350) has the molecular formula C12H10N4S and a molecular weight of 242.31 g/mol. Its IUPAC name is 3-(2-methylthieno[3,2-d]pyrimidin-4-yl)pyridin-4-amine.

Molecular Properties

Compound Name3-(2-methylthieno[3,2-d]pyrimidin-4-yl)pyridin-4-amine
PubChem CID157015350
Molecular FormulaC12H10N4S
Molecular Weight242.31 g/mol
Exact Mass242.06
IUPAC Name3-(2-methylthieno[3,2-d]pyrimidin-4-yl)pyridin-4-amine
SMILESCc1nc(-c2cnccc2N)c2sccc2n1
InChIInChI=1S/C12H10N4S/c1-7-15-10-3-5-17-12(10)11(16-7)8-6-14-4-2-9(8)13/h2-6H,1H3,(H2,13,14)
InChIKeyZSNDXANHBUHBBZ-UHFFFAOYSA-N
XLogP2.64
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.31
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methylthieno[3,2-d]pyrimidin-4-yl)pyridin-4-amine?
The IUPAC name of 3-(2-methylthieno[3,2-d]pyrimidin-4-yl)pyridin-4-amine (CID 157015350) is 3-(2-methylthieno[3,2-d]pyrimidin-4-yl)pyridin-4-amine.
What is the SMILES notation for 3-(2-methylthieno[3,2-d]pyrimidin-4-yl)pyridin-4-amine?
The canonical SMILES for 3-(2-methylthieno[3,2-d]pyrimidin-4-yl)pyridin-4-amine is Cc1nc(-c2cnccc2N)c2sccc2n1.
What is the InChIKey of 3-(2-methylthieno[3,2-d]pyrimidin-4-yl)pyridin-4-amine?
The InChIKey is ZSNDXANHBUHBBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4S/c1-7-15-10-3-5-17-12(10)11(16-7)8-6-14-4-2-9(8)13/h2-6H,1H3,(H2,13,14).
What are the key properties of 3-(2-methylthieno[3,2-d]pyrimidin-4-yl)pyridin-4-amine?
3-(2-methylthieno[3,2-d]pyrimidin-4-yl)pyridin-4-amine has a molecular weight of 242.31 g/mol, XLogP of 2.64, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylthieno[3,2-d]pyrimidin-4-yl)pyridin-4-amine is sourced from PubChem (CID 157015350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).