4-cyclopropylpyrimidin-2-amine

C7H9N3 — CID 3299593

IUPAC4-cyclopropylpyrimidin-2-amine
SMILESNc1nccc(C2CC2)n1
InChIInChI=1S/C7H9N3/c8-7-9-4-3-6(10-7)5-1-2-5/h3-5H,1-2H2,(H2,8,9,10)
InChIKeyWSRWIOBLJDEDRM-UHFFFAOYSA-N
MW135.17 g/mol
LogP0.94
Rot. Bonds1

About 4-cyclopropylpyrimidin-2-amine

4-cyclopropylpyrimidin-2-amine (PubChem CID 3299593) has the molecular formula C7H9N3 and a molecular weight of 135.17 g/mol. Its IUPAC name is 4-cyclopropylpyrimidin-2-amine.

Molecular Properties

Compound Name4-cyclopropylpyrimidin-2-amine
PubChem CID3299593
Molecular FormulaC7H9N3
Molecular Weight135.17 g/mol
Exact Mass135.08
IUPAC Name4-cyclopropylpyrimidin-2-amine
SMILESNc1nccc(C2CC2)n1
InChIInChI=1S/C7H9N3/c8-7-9-4-3-6(10-7)5-1-2-5/h3-5H,1-2H2,(H2,8,9,10)
InChIKeyWSRWIOBLJDEDRM-UHFFFAOYSA-N
XLogP0.94
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopropylpyrimidin-2-amine?
The IUPAC name of 4-cyclopropylpyrimidin-2-amine (CID 3299593) is 4-cyclopropylpyrimidin-2-amine.
What is the SMILES notation for 4-cyclopropylpyrimidin-2-amine?
The canonical SMILES for 4-cyclopropylpyrimidin-2-amine is Nc1nccc(C2CC2)n1.
What is the InChIKey of 4-cyclopropylpyrimidin-2-amine?
The InChIKey is WSRWIOBLJDEDRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3/c8-7-9-4-3-6(10-7)5-1-2-5/h3-5H,1-2H2,(H2,8,9,10).
What are the key properties of 4-cyclopropylpyrimidin-2-amine?
4-cyclopropylpyrimidin-2-amine has a molecular weight of 135.17 g/mol, XLogP of 0.94, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropylpyrimidin-2-amine is sourced from PubChem (CID 3299593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).