4-(6-methyl-2-piperazin-1-ylthieno[3,2-d]pyrimidin-4-yl)morpholine

C15H21N5OS — CID 154093189

IUPAC4-(6-methyl-2-piperazin-1-ylthieno[3,2-d]pyrimidin-4-yl)morpholine
SMILESCc1cc2nc(N3CCNCC3)nc(N3CCOCC3)c2s1
InChIInChI=1S/C15H21N5OS/c1-11-10-12-13(22-11)14(19-6-8-21-9-7-19)18-15(17-12)20-4-2-16-3-5-20/h10,16H,2-9H2,1H3
InChIKeyCNIDFKMQNJFLLR-UHFFFAOYSA-N
MW319.43 g/mol
LogP1.25
Rot. Bonds2

About 4-(6-methyl-2-piperazin-1-ylthieno[3,2-d]pyrimidin-4-yl)morpholine

4-(6-methyl-2-piperazin-1-ylthieno[3,2-d]pyrimidin-4-yl)morpholine (PubChem CID 154093189) has the molecular formula C15H21N5OS and a molecular weight of 319.43 g/mol. Its IUPAC name is 4-(6-methyl-2-piperazin-1-ylthieno[3,2-d]pyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name4-(6-methyl-2-piperazin-1-ylthieno[3,2-d]pyrimidin-4-yl)morpholine
PubChem CID154093189
Molecular FormulaC15H21N5OS
Molecular Weight319.43 g/mol
Exact Mass319.15
IUPAC Name4-(6-methyl-2-piperazin-1-ylthieno[3,2-d]pyrimidin-4-yl)morpholine
SMILESCc1cc2nc(N3CCNCC3)nc(N3CCOCC3)c2s1
InChIInChI=1S/C15H21N5OS/c1-11-10-12-13(22-11)14(19-6-8-21-9-7-19)18-15(17-12)20-4-2-16-3-5-20/h10,16H,2-9H2,1H3
InChIKeyCNIDFKMQNJFLLR-UHFFFAOYSA-N
XLogP1.25
TPSA53.52 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.43
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-(6-methyl-2-piperazin-1-ylthieno[3,2-d]pyrimidin-4-yl)morpholine?
The IUPAC name of 4-(6-methyl-2-piperazin-1-ylthieno[3,2-d]pyrimidin-4-yl)morpholine (CID 154093189) is 4-(6-methyl-2-piperazin-1-ylthieno[3,2-d]pyrimidin-4-yl)morpholine.
What is the SMILES notation for 4-(6-methyl-2-piperazin-1-ylthieno[3,2-d]pyrimidin-4-yl)morpholine?
The canonical SMILES for 4-(6-methyl-2-piperazin-1-ylthieno[3,2-d]pyrimidin-4-yl)morpholine is Cc1cc2nc(N3CCNCC3)nc(N3CCOCC3)c2s1.
What is the InChIKey of 4-(6-methyl-2-piperazin-1-ylthieno[3,2-d]pyrimidin-4-yl)morpholine?
The InChIKey is CNIDFKMQNJFLLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5OS/c1-11-10-12-13(22-11)14(19-6-8-21-9-7-19)18-15(17-12)20-4-2-16-3-5-20/h10,16H,2-9H2,1H3.
What are the key properties of 4-(6-methyl-2-piperazin-1-ylthieno[3,2-d]pyrimidin-4-yl)morpholine?
4-(6-methyl-2-piperazin-1-ylthieno[3,2-d]pyrimidin-4-yl)morpholine has a molecular weight of 319.43 g/mol, XLogP of 1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methyl-2-piperazin-1-ylthieno[3,2-d]pyrimidin-4-yl)morpholine is sourced from PubChem (CID 154093189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).