2,6-dimethyl-4-(7-methylthieno[3,2-d]pyrimidin-4-yl)morpholine

C13H17N3OS — CID 2808060

IUPAC2,6-dimethyl-4-(7-methylthieno[3,2-d]pyrimidin-4-yl)morpholine
SMILESCc1csc2c(N3CC(C)OC(C)C3)ncnc12
InChIInChI=1S/C13H17N3OS/c1-8-6-18-12-11(8)14-7-15-13(12)16-4-9(2)17-10(3)5-16/h6-7,9-10H,4-5H2,1-3H3
InChIKeyXYDHJGLXPQODOH-UHFFFAOYSA-N
MW263.37 g/mol
LogP2.61
Rot. Bonds1

About 2,6-dimethyl-4-(7-methylthieno[3,2-d]pyrimidin-4-yl)morpholine

2,6-dimethyl-4-(7-methylthieno[3,2-d]pyrimidin-4-yl)morpholine (PubChem CID 2808060) has the molecular formula C13H17N3OS and a molecular weight of 263.37 g/mol. Its IUPAC name is 2,6-dimethyl-4-(7-methylthieno[3,2-d]pyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name2,6-dimethyl-4-(7-methylthieno[3,2-d]pyrimidin-4-yl)morpholine
PubChem CID2808060
Molecular FormulaC13H17N3OS
Molecular Weight263.37 g/mol
Exact Mass263.11
IUPAC Name2,6-dimethyl-4-(7-methylthieno[3,2-d]pyrimidin-4-yl)morpholine
SMILESCc1csc2c(N3CC(C)OC(C)C3)ncnc12
InChIInChI=1S/C13H17N3OS/c1-8-6-18-12-11(8)14-7-15-13(12)16-4-9(2)17-10(3)5-16/h6-7,9-10H,4-5H2,1-3H3
InChIKeyXYDHJGLXPQODOH-UHFFFAOYSA-N
XLogP2.61
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.37
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-4-(7-methylthieno[3,2-d]pyrimidin-4-yl)morpholine?
The IUPAC name of 2,6-dimethyl-4-(7-methylthieno[3,2-d]pyrimidin-4-yl)morpholine (CID 2808060) is 2,6-dimethyl-4-(7-methylthieno[3,2-d]pyrimidin-4-yl)morpholine.
What is the SMILES notation for 2,6-dimethyl-4-(7-methylthieno[3,2-d]pyrimidin-4-yl)morpholine?
The canonical SMILES for 2,6-dimethyl-4-(7-methylthieno[3,2-d]pyrimidin-4-yl)morpholine is Cc1csc2c(N3CC(C)OC(C)C3)ncnc12.
What is the InChIKey of 2,6-dimethyl-4-(7-methylthieno[3,2-d]pyrimidin-4-yl)morpholine?
The InChIKey is XYDHJGLXPQODOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3OS/c1-8-6-18-12-11(8)14-7-15-13(12)16-4-9(2)17-10(3)5-16/h6-7,9-10H,4-5H2,1-3H3.
What are the key properties of 2,6-dimethyl-4-(7-methylthieno[3,2-d]pyrimidin-4-yl)morpholine?
2,6-dimethyl-4-(7-methylthieno[3,2-d]pyrimidin-4-yl)morpholine has a molecular weight of 263.37 g/mol, XLogP of 2.61, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-4-(7-methylthieno[3,2-d]pyrimidin-4-yl)morpholine is sourced from PubChem (CID 2808060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).