1-cyclopropyl-3-(2-phenylcyclopropyl)propan-1-amine

C₁₅H₂₁N — CID 116518273

About 1-cyclopropyl-3-(2-phenylcyclopropyl)propan-1-amine

1-cyclopropyl-3-(2-phenylcyclopropyl)propan-1-amine (PubChem CID 116518273) has the molecular formula C₁₅H₂₁N and a molecular weight of 215.34 g/mol. Its IUPAC name is 1-cyclopropyl-3-(2-phenylcyclopropyl)propan-1-amine.

Molecular Properties

• Compound Name: 1-cyclopropyl-3-(2-phenylcyclopropyl)propan-1-amine
• PubChem CID: 116518273
• Molecular Formula: C₁₅H₂₁N
• Molecular Weight: 215.34 g/mol
• Exact Mass: 215.17
• IUPAC Name: 1-cyclopropyl-3-(2-phenylcyclopropyl)propan-1-amine
• SMILES: NC(CCC1CC1c1ccccc1)C1CC1
• InChI: InChI=1S/C15H21N/c16-15(12-6-7-12)9-8-13-10-14(13)11-4-2-1-3-5-11/h1-5,12-15H,6-10,16H2
• InChIKey: ZBZKXBIYALSDGR-UHFFFAOYSA-N
• XLogP: 3.31
• TPSA: 26.02 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 1
• Rotatable Bonds: 5
• Heavy Atoms: 16
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	215.34
LogP ≤ 5	3.31
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	1

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(2-phenylcyclopropyl)propan-1-amine?

The IUPAC name of 1-cyclopropyl-3-(2-phenylcyclopropyl)propan-1-amine (CID 116518273) is 1-cyclopropyl-3-(2-phenylcyclopropyl)propan-1-amine.

What is the SMILES notation for 1-cyclopropyl-3-(2-phenylcyclopropyl)propan-1-amine?

The canonical SMILES for 1-cyclopropyl-3-(2-phenylcyclopropyl)propan-1-amine is NC(CCC1CC1c1ccccc1)C1CC1.

What is the InChIKey of 1-cyclopropyl-3-(2-phenylcyclopropyl)propan-1-amine?

The InChIKey is ZBZKXBIYALSDGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c16-15(12-6-7-12)9-8-13-10-14(13)11-4-2-1-3-5-11/h1-5,12-15H,6-10,16H2.

What are the key properties of 1-cyclopropyl-3-(2-phenylcyclopropyl)propan-1-amine?

1-cyclopropyl-3-(2-phenylcyclopropyl)propan-1-amine has a molecular weight of 215.34 g/mol, XLogP of 3.31, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for 1-cyclopropyl-3-(2-phenylcyclopropyl)propan-1-amine is sourced from PubChem (CID 116518273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 116518273 — identifiers, structure, computed properties (public domain)

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