2-(furan-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine

C15H16N4O2S — CID 45279725

IUPAC2-(furan-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
SMILESNc1nc(-c2ccco2)nc2sc(CN3CCOCC3)cc12
InChIInChI=1S/C15H16N4O2S/c16-13-11-8-10(9-19-3-6-20-7-4-19)22-15(11)18-14(17-13)12-2-1-5-21-12/h1-2,5,8H,3-4,6-7,9H2,(H2,16,17,18)
InChIKeyWKCYYQAUFYIEID-UHFFFAOYSA-N
MW316.39 g/mol
LogP2.37
Rot. Bonds3

About 2-(furan-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine

2-(furan-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 45279725) has the molecular formula C15H16N4O2S and a molecular weight of 316.39 g/mol. Its IUPAC name is 2-(furan-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(furan-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID45279725
Molecular FormulaC15H16N4O2S
Molecular Weight316.39 g/mol
Exact Mass316.10
IUPAC Name2-(furan-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
SMILESNc1nc(-c2ccco2)nc2sc(CN3CCOCC3)cc12
InChIInChI=1S/C15H16N4O2S/c16-13-11-8-10(9-19-3-6-20-7-4-19)22-15(11)18-14(17-13)12-2-1-5-21-12/h1-2,5,8H,3-4,6-7,9H2,(H2,16,17,18)
InChIKeyWKCYYQAUFYIEID-UHFFFAOYSA-N
XLogP2.37
TPSA77.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.39
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(furan-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine (CID 45279725) is 2-(furan-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(furan-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(furan-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine is Nc1nc(-c2ccco2)nc2sc(CN3CCOCC3)cc12.
What is the InChIKey of 2-(furan-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is WKCYYQAUFYIEID-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2S/c16-13-11-8-10(9-19-3-6-20-7-4-19)22-15(11)18-14(17-13)12-2-1-5-21-12/h1-2,5,8H,3-4,6-7,9H2,(H2,16,17,18).
What are the key properties of 2-(furan-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine?
2-(furan-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 316.39 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-6-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 45279725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).