1-pyrimidin-2-ylcyclopropan-1-amine

C7H9N3 — CID 56965659

IUPAC1-pyrimidin-2-ylcyclopropan-1-amine
SMILESNC1(c2ncccn2)CC1
InChIInChI=1S/C7H9N3/c8-7(2-3-7)6-9-4-1-5-10-6/h1,4-5H,2-3,8H2
InChIKeyOBSRDFSSNGPUIY-UHFFFAOYSA-N
MW135.17 g/mol
LogP0.42
Rot. Bonds1

About 1-pyrimidin-2-ylcyclopropan-1-amine

1-pyrimidin-2-ylcyclopropan-1-amine (PubChem CID 56965659) has the molecular formula C7H9N3 and a molecular weight of 135.17 g/mol. Its IUPAC name is 1-pyrimidin-2-ylcyclopropan-1-amine.

Molecular Properties

Compound Name1-pyrimidin-2-ylcyclopropan-1-amine
PubChem CID56965659
Molecular FormulaC7H9N3
Molecular Weight135.17 g/mol
Exact Mass135.08
IUPAC Name1-pyrimidin-2-ylcyclopropan-1-amine
SMILESNC1(c2ncccn2)CC1
InChIInChI=1S/C7H9N3/c8-7(2-3-7)6-9-4-1-5-10-6/h1,4-5H,2-3,8H2
InChIKeyOBSRDFSSNGPUIY-UHFFFAOYSA-N
XLogP0.42
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 ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-pyrimidin-2-ylcyclopropan-1-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 1-pyrimidin-2-ylcyclopropan-1-amine?
The IUPAC name of 1-pyrimidin-2-ylcyclopropan-1-amine (CID 56965659) is 1-pyrimidin-2-ylcyclopropan-1-amine.
What is the SMILES notation for 1-pyrimidin-2-ylcyclopropan-1-amine?
The canonical SMILES for 1-pyrimidin-2-ylcyclopropan-1-amine is NC1(c2ncccn2)CC1.
What is the InChIKey of 1-pyrimidin-2-ylcyclopropan-1-amine?
The InChIKey is OBSRDFSSNGPUIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3/c8-7(2-3-7)6-9-4-1-5-10-6/h1,4-5H,2-3,8H2.
What are the key properties of 1-pyrimidin-2-ylcyclopropan-1-amine?
1-pyrimidin-2-ylcyclopropan-1-amine has a molecular weight of 135.17 g/mol, XLogP of 0.42, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrimidin-2-ylcyclopropan-1-amine is sourced from PubChem (CID 56965659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).