7-ethylthieno[3,2-d]pyrimidin-4-amine

C8H9N3S — CID 130182764

IUPAC7-ethylthieno[3,2-d]pyrimidin-4-amine
SMILESCCc1csc2c(N)ncnc12
InChIInChI=1S/C8H9N3S/c1-2-5-3-12-7-6(5)10-4-11-8(7)9/h3-4H,2H2,1H3,(H2,9,10,11)
InChIKeyNLMNYMXTWMHUPM-UHFFFAOYSA-N
MW179.25 g/mol
LogP1.84
Rot. Bonds1

About 7-ethylthieno[3,2-d]pyrimidin-4-amine

7-ethylthieno[3,2-d]pyrimidin-4-amine (PubChem CID 130182764) has the molecular formula C8H9N3S and a molecular weight of 179.25 g/mol. Its IUPAC name is 7-ethylthieno[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name7-ethylthieno[3,2-d]pyrimidin-4-amine
PubChem CID130182764
Molecular FormulaC8H9N3S
Molecular Weight179.25 g/mol
Exact Mass179.05
IUPAC Name7-ethylthieno[3,2-d]pyrimidin-4-amine
SMILESCCc1csc2c(N)ncnc12
InChIInChI=1S/C8H9N3S/c1-2-5-3-12-7-6(5)10-4-11-8(7)9/h3-4H,2H2,1H3,(H2,9,10,11)
InChIKeyNLMNYMXTWMHUPM-UHFFFAOYSA-N
XLogP1.84
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.25
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-ethylthieno[3,2-d]pyrimidin-4-amine?
The IUPAC name of 7-ethylthieno[3,2-d]pyrimidin-4-amine (CID 130182764) is 7-ethylthieno[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 7-ethylthieno[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 7-ethylthieno[3,2-d]pyrimidin-4-amine is CCc1csc2c(N)ncnc12.
What is the InChIKey of 7-ethylthieno[3,2-d]pyrimidin-4-amine?
The InChIKey is NLMNYMXTWMHUPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3S/c1-2-5-3-12-7-6(5)10-4-11-8(7)9/h3-4H,2H2,1H3,(H2,9,10,11).
What are the key properties of 7-ethylthieno[3,2-d]pyrimidin-4-amine?
7-ethylthieno[3,2-d]pyrimidin-4-amine has a molecular weight of 179.25 g/mol, XLogP of 1.84, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethylthieno[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 130182764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).