2-(furan-3-yl)-6-propylpyrimidin-4-amine

C11H13N3O — CID 63204623

IUPAC2-(furan-3-yl)-6-propylpyrimidin-4-amine
SMILESCCCc1cc(N)nc(-c2ccoc2)n1
InChIInChI=1S/C11H13N3O/c1-2-3-9-6-10(12)14-11(13-9)8-4-5-15-7-8/h4-7H,2-3H2,1H3,(H2,12,13,14)
InChIKeyUXLPESMEIPXKMK-UHFFFAOYSA-N
MW203.25 g/mol
LogP2.27
Rot. Bonds3

About 2-(furan-3-yl)-6-propylpyrimidin-4-amine

2-(furan-3-yl)-6-propylpyrimidin-4-amine (PubChem CID 63204623) has the molecular formula C11H13N3O and a molecular weight of 203.25 g/mol. Its IUPAC name is 2-(furan-3-yl)-6-propylpyrimidin-4-amine.

Molecular Properties

Compound Name2-(furan-3-yl)-6-propylpyrimidin-4-amine
PubChem CID63204623
Molecular FormulaC11H13N3O
Molecular Weight203.25 g/mol
Exact Mass203.11
IUPAC Name2-(furan-3-yl)-6-propylpyrimidin-4-amine
SMILESCCCc1cc(N)nc(-c2ccoc2)n1
InChIInChI=1S/C11H13N3O/c1-2-3-9-6-10(12)14-11(13-9)8-4-5-15-7-8/h4-7H,2-3H2,1H3,(H2,12,13,14)
InChIKeyUXLPESMEIPXKMK-UHFFFAOYSA-N
XLogP2.27
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-6-propylpyrimidin-4-amine?
The IUPAC name of 2-(furan-3-yl)-6-propylpyrimidin-4-amine (CID 63204623) is 2-(furan-3-yl)-6-propylpyrimidin-4-amine.
What is the SMILES notation for 2-(furan-3-yl)-6-propylpyrimidin-4-amine?
The canonical SMILES for 2-(furan-3-yl)-6-propylpyrimidin-4-amine is CCCc1cc(N)nc(-c2ccoc2)n1.
What is the InChIKey of 2-(furan-3-yl)-6-propylpyrimidin-4-amine?
The InChIKey is UXLPESMEIPXKMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3O/c1-2-3-9-6-10(12)14-11(13-9)8-4-5-15-7-8/h4-7H,2-3H2,1H3,(H2,12,13,14).
What are the key properties of 2-(furan-3-yl)-6-propylpyrimidin-4-amine?
2-(furan-3-yl)-6-propylpyrimidin-4-amine has a molecular weight of 203.25 g/mol, XLogP of 2.27, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-6-propylpyrimidin-4-amine is sourced from PubChem (CID 63204623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).