2-methyl-4-morpholin-4-yl-[1]benzofuro[3,2-d]pyrimidine

C15H15N3O2 — CID 656347

IUPAC2-methyl-4-morpholin-4-yl-[1]benzofuro[3,2-d]pyrimidine
SMILESCc1nc(N2CCOCC2)c2oc3ccccc3c2n1
InChIInChI=1S/C15H15N3O2/c1-10-16-13-11-4-2-3-5-12(11)20-14(13)15(17-10)18-6-8-19-9-7-18/h2-5H,6-9H2,1H3
InChIKeyKLULAADISSTNPD-UHFFFAOYSA-N
MW269.30 g/mol
LogP2.52
Rot. Bonds1

About 2-methyl-4-morpholin-4-yl-[1]benzofuro[3,2-d]pyrimidine

2-methyl-4-morpholin-4-yl-[1]benzofuro[3,2-d]pyrimidine (PubChem CID 656347) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is 2-methyl-4-morpholin-4-yl-[1]benzofuro[3,2-d]pyrimidine.

Molecular Properties

Compound Name2-methyl-4-morpholin-4-yl-[1]benzofuro[3,2-d]pyrimidine
PubChem CID656347
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC Name2-methyl-4-morpholin-4-yl-[1]benzofuro[3,2-d]pyrimidine
SMILESCc1nc(N2CCOCC2)c2oc3ccccc3c2n1
InChIInChI=1S/C15H15N3O2/c1-10-16-13-11-4-2-3-5-12(11)20-14(13)15(17-10)18-6-8-19-9-7-18/h2-5H,6-9H2,1H3
InChIKeyKLULAADISSTNPD-UHFFFAOYSA-N
XLogP2.52
TPSA51.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-morpholin-4-yl-[1]benzofuro[3,2-d]pyrimidine?
The IUPAC name of 2-methyl-4-morpholin-4-yl-[1]benzofuro[3,2-d]pyrimidine (CID 656347) is 2-methyl-4-morpholin-4-yl-[1]benzofuro[3,2-d]pyrimidine.
What is the SMILES notation for 2-methyl-4-morpholin-4-yl-[1]benzofuro[3,2-d]pyrimidine?
The canonical SMILES for 2-methyl-4-morpholin-4-yl-[1]benzofuro[3,2-d]pyrimidine is Cc1nc(N2CCOCC2)c2oc3ccccc3c2n1.
What is the InChIKey of 2-methyl-4-morpholin-4-yl-[1]benzofuro[3,2-d]pyrimidine?
The InChIKey is KLULAADISSTNPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-10-16-13-11-4-2-3-5-12(11)20-14(13)15(17-10)18-6-8-19-9-7-18/h2-5H,6-9H2,1H3.
What are the key properties of 2-methyl-4-morpholin-4-yl-[1]benzofuro[3,2-d]pyrimidine?
2-methyl-4-morpholin-4-yl-[1]benzofuro[3,2-d]pyrimidine has a molecular weight of 269.30 g/mol, XLogP of 2.52, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-morpholin-4-yl-[1]benzofuro[3,2-d]pyrimidine is sourced from PubChem (CID 656347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).