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

C11H13N3OS — CID 1277400

IUPAC4-(2-methylthieno[2,3-d]pyrimidin-4-yl)morpholine
SMILESCc1nc(N2CCOCC2)c2ccsc2n1
InChIInChI=1S/C11H13N3OS/c1-8-12-10(14-3-5-15-6-4-14)9-2-7-16-11(9)13-8/h2,7H,3-6H2,1H3
InChIKeyORWVZMJDHDFKBI-UHFFFAOYSA-N
MW235.31 g/mol
LogP1.84
Rot. Bonds1

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

4-(2-methylthieno[2,3-d]pyrimidin-4-yl)morpholine (PubChem CID 1277400) has the molecular formula C11H13N3OS and a molecular weight of 235.31 g/mol. Its IUPAC name is 4-(2-methylthieno[2,3-d]pyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name4-(2-methylthieno[2,3-d]pyrimidin-4-yl)morpholine
PubChem CID1277400
Molecular FormulaC11H13N3OS
Molecular Weight235.31 g/mol
Exact Mass235.08
IUPAC Name4-(2-methylthieno[2,3-d]pyrimidin-4-yl)morpholine
SMILESCc1nc(N2CCOCC2)c2ccsc2n1
InChIInChI=1S/C11H13N3OS/c1-8-12-10(14-3-5-15-6-4-14)9-2-7-16-11(9)13-8/h2,7H,3-6H2,1H3
InChIKeyORWVZMJDHDFKBI-UHFFFAOYSA-N
XLogP1.84
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.31
LogP ≤ 51.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methylthieno[2,3-d]pyrimidin-4-yl)morpholine?
The IUPAC name of 4-(2-methylthieno[2,3-d]pyrimidin-4-yl)morpholine (CID 1277400) is 4-(2-methylthieno[2,3-d]pyrimidin-4-yl)morpholine.
What is the SMILES notation for 4-(2-methylthieno[2,3-d]pyrimidin-4-yl)morpholine?
The canonical SMILES for 4-(2-methylthieno[2,3-d]pyrimidin-4-yl)morpholine is Cc1nc(N2CCOCC2)c2ccsc2n1.
What is the InChIKey of 4-(2-methylthieno[2,3-d]pyrimidin-4-yl)morpholine?
The InChIKey is ORWVZMJDHDFKBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3OS/c1-8-12-10(14-3-5-15-6-4-14)9-2-7-16-11(9)13-8/h2,7H,3-6H2,1H3.
What are the key properties of 4-(2-methylthieno[2,3-d]pyrimidin-4-yl)morpholine?
4-(2-methylthieno[2,3-d]pyrimidin-4-yl)morpholine has a molecular weight of 235.31 g/mol, XLogP of 1.84, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylthieno[2,3-d]pyrimidin-4-yl)morpholine is sourced from PubChem (CID 1277400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).