1,2,3-trimethylcyclopent-2-en-1-amine

C₈H₁₅N — CID 145499311

About 1,2,3-trimethylcyclopent-2-en-1-amine

1,2,3-trimethylcyclopent-2-en-1-amine (PubChem CID 145499311) has the molecular formula C₈H₁₅N and a molecular weight of 125.21 g/mol. Its IUPAC name is 1,2,3-trimethylcyclopent-2-en-1-amine.

Molecular Properties

• Compound Name: 1,2,3-trimethylcyclopent-2-en-1-amine
• PubChem CID: 145499311
• Molecular Formula: C₈H₁₅N
• Molecular Weight: 125.21 g/mol
• Exact Mass: 125.12
• IUPAC Name: 1,2,3-trimethylcyclopent-2-en-1-amine
• SMILES: CC1=C(C)C(C)(N)CC1
• InChI: InChI=1S/C8H15N/c1-6-4-5-8(3,9)7(6)2/h4-5,9H2,1-3H3
• InChIKey: GBJLNJNKXJNWIA-UHFFFAOYSA-N
• XLogP: 1.83
• TPSA: 26.02 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 1
• Heavy Atoms: 9
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	125.21
LogP ≤ 5	1.83
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	1

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1,2,3-trimethylcyclopent-2-en-1-amine?

The IUPAC name of 1,2,3-trimethylcyclopent-2-en-1-amine (CID 145499311) is 1,2,3-trimethylcyclopent-2-en-1-amine.

What is the SMILES notation for 1,2,3-trimethylcyclopent-2-en-1-amine?

The canonical SMILES for 1,2,3-trimethylcyclopent-2-en-1-amine is CC1=C(C)C(C)(N)CC1.

What is the InChIKey of 1,2,3-trimethylcyclopent-2-en-1-amine?

The InChIKey is GBJLNJNKXJNWIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-6-4-5-8(3,9)7(6)2/h4-5,9H2,1-3H3.

What are the key properties of 1,2,3-trimethylcyclopent-2-en-1-amine?

1,2,3-trimethylcyclopent-2-en-1-amine has a molecular weight of 125.21 g/mol, XLogP of 1.83, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for 1,2,3-trimethylcyclopent-2-en-1-amine is sourced from PubChem (CID 145499311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 145499311 — identifiers, structure, computed properties (public domain)

How this page is built: methodology · editorial policy & corrections.