6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-amine

C13H11N3O2 — CID 5329802

IUPAC6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-amine
SMILESCOc1ccc(-c2cc3c(N)ncnc3o2)cc1
InChIInChI=1S/C13H11N3O2/c1-17-9-4-2-8(3-5-9)11-6-10-12(14)15-7-16-13(10)18-11/h2-7H,1H3,(H2,14,15,16)
InChIKeyDIJLFIHLUYAZCI-UHFFFAOYSA-N
MW241.25 g/mol
LogP2.48
Rot. Bonds2

About 6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-amine

6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-amine (PubChem CID 5329802) has the molecular formula C13H11N3O2 and a molecular weight of 241.25 g/mol. Its IUPAC name is 6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-amine
PubChem CID5329802
Molecular FormulaC13H11N3O2
Molecular Weight241.25 g/mol
Exact Mass241.09
IUPAC Name6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-amine
SMILESCOc1ccc(-c2cc3c(N)ncnc3o2)cc1
InChIInChI=1S/C13H11N3O2/c1-17-9-4-2-8(3-5-9)11-6-10-12(14)15-7-16-13(10)18-11/h2-7H,1H3,(H2,14,15,16)
InChIKeyDIJLFIHLUYAZCI-UHFFFAOYSA-N
XLogP2.48
TPSA74.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-amine?
The IUPAC name of 6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-amine (CID 5329802) is 6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-amine is COc1ccc(-c2cc3c(N)ncnc3o2)cc1.
What is the InChIKey of 6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-amine?
The InChIKey is DIJLFIHLUYAZCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O2/c1-17-9-4-2-8(3-5-9)11-6-10-12(14)15-7-16-13(10)18-11/h2-7H,1H3,(H2,14,15,16).
What are the key properties of 6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-amine?
6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-amine has a molecular weight of 241.25 g/mol, XLogP of 2.48, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methoxyphenyl)furo[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 5329802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).