4-(2,6-dichlorothieno[2,3-d]pyrimidin-4-yl)morpholine

C10H9Cl2N3OS — CID 86624262

IUPAC4-(2,6-dichlorothieno[2,3-d]pyrimidin-4-yl)morpholine
SMILESClc1nc(N2CCOCC2)c2cc(Cl)sc2n1
InChIInChI=1S/C10H9Cl2N3OS/c11-7-5-6-8(15-1-3-16-4-2-15)13-10(12)14-9(6)17-7/h5H,1-4H2
InChIKeyAFAGYGFLIADEAE-UHFFFAOYSA-N
MW290.18 g/mol
LogP2.83
Rot. Bonds1

About 4-(2,6-dichlorothieno[2,3-d]pyrimidin-4-yl)morpholine

4-(2,6-dichlorothieno[2,3-d]pyrimidin-4-yl)morpholine (PubChem CID 86624262) has the molecular formula C10H9Cl2N3OS and a molecular weight of 290.18 g/mol. Its IUPAC name is 4-(2,6-dichlorothieno[2,3-d]pyrimidin-4-yl)morpholine.

Molecular Properties

Compound Name4-(2,6-dichlorothieno[2,3-d]pyrimidin-4-yl)morpholine
PubChem CID86624262
Molecular FormulaC10H9Cl2N3OS
Molecular Weight290.18 g/mol
Exact Mass288.98
IUPAC Name4-(2,6-dichlorothieno[2,3-d]pyrimidin-4-yl)morpholine
SMILESClc1nc(N2CCOCC2)c2cc(Cl)sc2n1
InChIInChI=1S/C10H9Cl2N3OS/c11-7-5-6-8(15-1-3-16-4-2-15)13-10(12)14-9(6)17-7/h5H,1-4H2
InChIKeyAFAGYGFLIADEAE-UHFFFAOYSA-N
XLogP2.83
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.18
LogP ≤ 52.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dichlorothieno[2,3-d]pyrimidin-4-yl)morpholine?
The IUPAC name of 4-(2,6-dichlorothieno[2,3-d]pyrimidin-4-yl)morpholine (CID 86624262) is 4-(2,6-dichlorothieno[2,3-d]pyrimidin-4-yl)morpholine.
What is the SMILES notation for 4-(2,6-dichlorothieno[2,3-d]pyrimidin-4-yl)morpholine?
The canonical SMILES for 4-(2,6-dichlorothieno[2,3-d]pyrimidin-4-yl)morpholine is Clc1nc(N2CCOCC2)c2cc(Cl)sc2n1.
What is the InChIKey of 4-(2,6-dichlorothieno[2,3-d]pyrimidin-4-yl)morpholine?
The InChIKey is AFAGYGFLIADEAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9Cl2N3OS/c11-7-5-6-8(15-1-3-16-4-2-15)13-10(12)14-9(6)17-7/h5H,1-4H2.
What are the key properties of 4-(2,6-dichlorothieno[2,3-d]pyrimidin-4-yl)morpholine?
4-(2,6-dichlorothieno[2,3-d]pyrimidin-4-yl)morpholine has a molecular weight of 290.18 g/mol, XLogP of 2.83, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dichlorothieno[2,3-d]pyrimidin-4-yl)morpholine is sourced from PubChem (CID 86624262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).