6-methyl-5-phenylfuro[2,3-d]pyrimidin-4-amine

C13H11N3O — CID 71048556

IUPAC6-methyl-5-phenylfuro[2,3-d]pyrimidin-4-amine
SMILESCc1oc2ncnc(N)c2c1-c1ccccc1
InChIInChI=1S/C13H11N3O/c1-8-10(9-5-3-2-4-6-9)11-12(14)15-7-16-13(11)17-8/h2-7H,1H3,(H2,14,15,16)
InChIKeyBBKUNPBSJCFQOY-UHFFFAOYSA-N
MW225.25 g/mol
LogP2.78
Rot. Bonds1

About 6-methyl-5-phenylfuro[2,3-d]pyrimidin-4-amine

6-methyl-5-phenylfuro[2,3-d]pyrimidin-4-amine (PubChem CID 71048556) has the molecular formula C13H11N3O and a molecular weight of 225.25 g/mol. Its IUPAC name is 6-methyl-5-phenylfuro[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-5-phenylfuro[2,3-d]pyrimidin-4-amine
PubChem CID71048556
Molecular FormulaC13H11N3O
Molecular Weight225.25 g/mol
Exact Mass225.09
IUPAC Name6-methyl-5-phenylfuro[2,3-d]pyrimidin-4-amine
SMILESCc1oc2ncnc(N)c2c1-c1ccccc1
InChIInChI=1S/C13H11N3O/c1-8-10(9-5-3-2-4-6-9)11-12(14)15-7-16-13(11)17-8/h2-7H,1H3,(H2,14,15,16)
InChIKeyBBKUNPBSJCFQOY-UHFFFAOYSA-N
XLogP2.78
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-5-phenylfuro[2,3-d]pyrimidin-4-amine?
The IUPAC name of 6-methyl-5-phenylfuro[2,3-d]pyrimidin-4-amine (CID 71048556) is 6-methyl-5-phenylfuro[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 6-methyl-5-phenylfuro[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 6-methyl-5-phenylfuro[2,3-d]pyrimidin-4-amine is Cc1oc2ncnc(N)c2c1-c1ccccc1.
What is the InChIKey of 6-methyl-5-phenylfuro[2,3-d]pyrimidin-4-amine?
The InChIKey is BBKUNPBSJCFQOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O/c1-8-10(9-5-3-2-4-6-9)11-12(14)15-7-16-13(11)17-8/h2-7H,1H3,(H2,14,15,16).
What are the key properties of 6-methyl-5-phenylfuro[2,3-d]pyrimidin-4-amine?
6-methyl-5-phenylfuro[2,3-d]pyrimidin-4-amine has a molecular weight of 225.25 g/mol, XLogP of 2.78, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5-phenylfuro[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 71048556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).