7-methoxy-[1]benzofuro[3,2-d]pyrimidin-4-amine

C11H9N3O2 — CID 71568938

IUPAC7-methoxy-[1]benzofuro[3,2-d]pyrimidin-4-amine
SMILESCOc1ccc2c(c1)oc1c(N)ncnc12
InChIInChI=1S/C11H9N3O2/c1-15-6-2-3-7-8(4-6)16-10-9(7)13-5-14-11(10)12/h2-5H,1H3,(H2,12,13,14)
InChIKeyBXPKEYOXQGAPPD-UHFFFAOYSA-N
MW215.21 g/mol
LogP1.97
Rot. Bonds1

About 7-methoxy-[1]benzofuro[3,2-d]pyrimidin-4-amine

7-methoxy-[1]benzofuro[3,2-d]pyrimidin-4-amine (PubChem CID 71568938) has the molecular formula C11H9N3O2 and a molecular weight of 215.21 g/mol. Its IUPAC name is 7-methoxy-[1]benzofuro[3,2-d]pyrimidin-4-amine.

Molecular Properties

Compound Name7-methoxy-[1]benzofuro[3,2-d]pyrimidin-4-amine
PubChem CID71568938
Molecular FormulaC11H9N3O2
Molecular Weight215.21 g/mol
Exact Mass215.07
IUPAC Name7-methoxy-[1]benzofuro[3,2-d]pyrimidin-4-amine
SMILESCOc1ccc2c(c1)oc1c(N)ncnc12
InChIInChI=1S/C11H9N3O2/c1-15-6-2-3-7-8(4-6)16-10-9(7)13-5-14-11(10)12/h2-5H,1H3,(H2,12,13,14)
InChIKeyBXPKEYOXQGAPPD-UHFFFAOYSA-N
XLogP1.97
TPSA74.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.21
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-methoxy-[1]benzofuro[3,2-d]pyrimidin-4-amine?
The IUPAC name of 7-methoxy-[1]benzofuro[3,2-d]pyrimidin-4-amine (CID 71568938) is 7-methoxy-[1]benzofuro[3,2-d]pyrimidin-4-amine.
What is the SMILES notation for 7-methoxy-[1]benzofuro[3,2-d]pyrimidin-4-amine?
The canonical SMILES for 7-methoxy-[1]benzofuro[3,2-d]pyrimidin-4-amine is COc1ccc2c(c1)oc1c(N)ncnc12.
What is the InChIKey of 7-methoxy-[1]benzofuro[3,2-d]pyrimidin-4-amine?
The InChIKey is BXPKEYOXQGAPPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3O2/c1-15-6-2-3-7-8(4-6)16-10-9(7)13-5-14-11(10)12/h2-5H,1H3,(H2,12,13,14).
What are the key properties of 7-methoxy-[1]benzofuro[3,2-d]pyrimidin-4-amine?
7-methoxy-[1]benzofuro[3,2-d]pyrimidin-4-amine has a molecular weight of 215.21 g/mol, XLogP of 1.97, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-[1]benzofuro[3,2-d]pyrimidin-4-amine is sourced from PubChem (CID 71568938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).