4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine

C14H13N3OS2 — CID 133363726

IUPAC4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine
SMILESc1csc(C2CN(c3ncnc4sccc34)CCO2)c1
InChIInChI=1S/C14H13N3OS2/c1-2-12(19-6-1)11-8-17(4-5-18-11)13-10-3-7-20-14(10)16-9-15-13/h1-3,6-7,9,11H,4-5,8H2
InChIKeyIYFUWFGQNBSTHB-UHFFFAOYSA-N
MW303.41 g/mol
LogP3.33
Rot. Bonds2

About 4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine

4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine (PubChem CID 133363726) has the molecular formula C14H13N3OS2 and a molecular weight of 303.41 g/mol. Its IUPAC name is 4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine.

Molecular Properties

Compound Name4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine
PubChem CID133363726
Molecular FormulaC14H13N3OS2
Molecular Weight303.41 g/mol
Exact Mass303.05
IUPAC Name4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine
SMILESc1csc(C2CN(c3ncnc4sccc34)CCO2)c1
InChIInChI=1S/C14H13N3OS2/c1-2-12(19-6-1)11-8-17(4-5-18-11)13-10-3-7-20-14(10)16-9-15-13/h1-3,6-7,9,11H,4-5,8H2
InChIKeyIYFUWFGQNBSTHB-UHFFFAOYSA-N
XLogP3.33
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine with MolForge

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Related Compounds

4-(1-phenylpyrazolo[5,4-d]pyrimidin-4-yl)-2-thiophen-2-ylmorpholine
CID 133363467
4-thieno[2,3-d]pyrimidin-4-ylmorpholine
CID 2457329
(2S)-2-[(4-methylpyrazol-1-yl)methyl]-4-thieno[2,3-d]pyrimidin-4-ylmorpholine
CID 95337729
1-thieno[2,3-d]pyrimidin-4-ylpiperidin-3-ol
CID 18074911
4-[3-(chloromethyl)pyrrolidin-1-yl]thieno[2,3-d]pyrimidine
CID 63390055
(3R)-1-thieno[2,3-d]pyrimidin-4-ylpiperidin-3-ol
CID 9283193
4-[(4aR,8aS)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinolin-2-yl]thieno[2,3-d]pyrimidine
CID 11936596
4-[3-(bromomethyl)pyrrolidin-1-yl]thieno[2,3-d]pyrimidine
CID 80679387
4-(1,2,4,5-tetrahydro-3-benzazepin-3-yl)thieno[2,3-d]pyrimidine
CID 157019262
4-(4-methyl-3-nitro-2-pyridinyl)-2-thiophen-2-ylmorpholine
CID 133363579
4-chloro-2-methyl-5-(2-thiophen-2-ylmorpholin-4-yl)pyridazin-3-one
CID 133363707
2-thiophen-2-ylmorpholin-4-amine
CID 82280994

Frequently Asked Questions

What is the IUPAC name of 4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine?
The IUPAC name of 4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine (CID 133363726) is 4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine.
What is the SMILES notation for 4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine?
The canonical SMILES for 4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine is c1csc(C2CN(c3ncnc4sccc34)CCO2)c1.
What is the InChIKey of 4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine?
The InChIKey is IYFUWFGQNBSTHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3OS2/c1-2-12(19-6-1)11-8-17(4-5-18-11)13-10-3-7-20-14(10)16-9-15-13/h1-3,6-7,9,11H,4-5,8H2.
What are the key properties of 4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine?
4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine has a molecular weight of 303.41 g/mol, XLogP of 3.33, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-thieno[2,3-d]pyrimidin-4-yl-2-thiophen-2-ylmorpholine is sourced from PubChem (CID 133363726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).