2-(3-ethyl-2-pyridinyl)-N-methylthieno[2,3-d]pyrimidin-4-amine

C14H14N4S — CID 82741495

IUPAC2-(3-ethyl-2-pyridinyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCCc1cccnc1-c1nc(NC)c2ccsc2n1
InChIInChI=1S/C14H14N4S/c1-3-9-5-4-7-16-11(9)13-17-12(15-2)10-6-8-19-14(10)18-13/h4-8H,3H2,1-2H3,(H,15,17,18)
InChIKeyVLHHUYUJIYQNGB-UHFFFAOYSA-N
MW270.36 g/mol
LogP3.36
Rot. Bonds3

About 2-(3-ethyl-2-pyridinyl)-N-methylthieno[2,3-d]pyrimidin-4-amine

2-(3-ethyl-2-pyridinyl)-N-methylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 82741495) has the molecular formula C14H14N4S and a molecular weight of 270.36 g/mol. Its IUPAC name is 2-(3-ethyl-2-pyridinyl)-N-methylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(3-ethyl-2-pyridinyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
PubChem CID82741495
Molecular FormulaC14H14N4S
Molecular Weight270.36 g/mol
Exact Mass270.09
IUPAC Name2-(3-ethyl-2-pyridinyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
SMILESCCc1cccnc1-c1nc(NC)c2ccsc2n1
InChIInChI=1S/C14H14N4S/c1-3-9-5-4-7-16-11(9)13-17-12(15-2)10-6-8-19-14(10)18-13/h4-8H,3H2,1-2H3,(H,15,17,18)
InChIKeyVLHHUYUJIYQNGB-UHFFFAOYSA-N
XLogP3.36
TPSA50.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-ethyl-2-pyridinyl)-N-methylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(3-ethyl-2-pyridinyl)-N-methylthieno[2,3-d]pyrimidin-4-amine (CID 82741495) is 2-(3-ethyl-2-pyridinyl)-N-methylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(3-ethyl-2-pyridinyl)-N-methylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(3-ethyl-2-pyridinyl)-N-methylthieno[2,3-d]pyrimidin-4-amine is CCc1cccnc1-c1nc(NC)c2ccsc2n1.
What is the InChIKey of 2-(3-ethyl-2-pyridinyl)-N-methylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is VLHHUYUJIYQNGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N4S/c1-3-9-5-4-7-16-11(9)13-17-12(15-2)10-6-8-19-14(10)18-13/h4-8H,3H2,1-2H3,(H,15,17,18).
What are the key properties of 2-(3-ethyl-2-pyridinyl)-N-methylthieno[2,3-d]pyrimidin-4-amine?
2-(3-ethyl-2-pyridinyl)-N-methylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 270.36 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethyl-2-pyridinyl)-N-methylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 82741495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).