N-cyclopropyl-2-(furan-3-yl)pyrimidin-4-amine

C11H11N3O — CID 3234167

IUPACN-cyclopropyl-2-(furan-3-yl)pyrimidin-4-amine
SMILESc1cc(NC2CC2)nc(-c2ccoc2)n1
InChIInChI=1S/C11H11N3O/c1-2-9(1)13-10-3-5-12-11(14-10)8-4-6-15-7-8/h3-7,9H,1-2H2,(H,12,13,14)
InChIKeyITBQVUHQAISPBQ-UHFFFAOYSA-N
MW201.23 g/mol
LogP2.31
Rot. Bonds3

About N-cyclopropyl-2-(furan-3-yl)pyrimidin-4-amine

N-cyclopropyl-2-(furan-3-yl)pyrimidin-4-amine (PubChem CID 3234167) has the molecular formula C11H11N3O and a molecular weight of 201.23 g/mol. Its IUPAC name is N-cyclopropyl-2-(furan-3-yl)pyrimidin-4-amine.

Molecular Properties

Compound NameN-cyclopropyl-2-(furan-3-yl)pyrimidin-4-amine
PubChem CID3234167
Molecular FormulaC11H11N3O
Molecular Weight201.23 g/mol
Exact Mass201.09
IUPAC NameN-cyclopropyl-2-(furan-3-yl)pyrimidin-4-amine
SMILESc1cc(NC2CC2)nc(-c2ccoc2)n1
InChIInChI=1S/C11H11N3O/c1-2-9(1)13-10-3-5-12-11(14-10)8-4-6-15-7-8/h3-7,9H,1-2H2,(H,12,13,14)
InChIKeyITBQVUHQAISPBQ-UHFFFAOYSA-N
XLogP2.31
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(furan-3-yl)pyrimidin-4-amine?
The IUPAC name of N-cyclopropyl-2-(furan-3-yl)pyrimidin-4-amine (CID 3234167) is N-cyclopropyl-2-(furan-3-yl)pyrimidin-4-amine.
What is the SMILES notation for N-cyclopropyl-2-(furan-3-yl)pyrimidin-4-amine?
The canonical SMILES for N-cyclopropyl-2-(furan-3-yl)pyrimidin-4-amine is c1cc(NC2CC2)nc(-c2ccoc2)n1.
What is the InChIKey of N-cyclopropyl-2-(furan-3-yl)pyrimidin-4-amine?
The InChIKey is ITBQVUHQAISPBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O/c1-2-9(1)13-10-3-5-12-11(14-10)8-4-6-15-7-8/h3-7,9H,1-2H2,(H,12,13,14).
What are the key properties of N-cyclopropyl-2-(furan-3-yl)pyrimidin-4-amine?
N-cyclopropyl-2-(furan-3-yl)pyrimidin-4-amine has a molecular weight of 201.23 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(furan-3-yl)pyrimidin-4-amine is sourced from PubChem (CID 3234167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).