2-cyclopent-2-en-1-yl-N-methylethanamine

C8H15N — CID 15668609

IUPAC2-cyclopent-2-en-1-yl-N-methylethanamine
SMILESCNCCC1C=CCC1
InChIInChI=1S/C8H15N/c1-9-7-6-8-4-2-3-5-8/h2,4,8-9H,3,5-7H2,1H3
InChIKeyMFQJXUVJRPLZNM-UHFFFAOYSA-N
MW125.21 g/mol
LogP1.56
Rot. Bonds3

About 2-cyclopent-2-en-1-yl-N-methylethanamine

2-cyclopent-2-en-1-yl-N-methylethanamine (PubChem CID 15668609) has the molecular formula C8H15N and a molecular weight of 125.21 g/mol. Its IUPAC name is 2-cyclopent-2-en-1-yl-N-methylethanamine.

Molecular Properties

Compound Name2-cyclopent-2-en-1-yl-N-methylethanamine
PubChem CID15668609
Molecular FormulaC8H15N
Molecular Weight125.21 g/mol
Exact Mass125.12
IUPAC Name2-cyclopent-2-en-1-yl-N-methylethanamine
SMILESCNCCC1C=CCC1
InChIInChI=1S/C8H15N/c1-9-7-6-8-4-2-3-5-8/h2,4,8-9H,3,5-7H2,1H3
InChIKeyMFQJXUVJRPLZNM-UHFFFAOYSA-N
XLogP1.56
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.21
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopent-2-en-1-yl-N-methylethanamine?
The IUPAC name of 2-cyclopent-2-en-1-yl-N-methylethanamine (CID 15668609) is 2-cyclopent-2-en-1-yl-N-methylethanamine.
What is the SMILES notation for 2-cyclopent-2-en-1-yl-N-methylethanamine?
The canonical SMILES for 2-cyclopent-2-en-1-yl-N-methylethanamine is CNCCC1C=CCC1.
What is the InChIKey of 2-cyclopent-2-en-1-yl-N-methylethanamine?
The InChIKey is MFQJXUVJRPLZNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-9-7-6-8-4-2-3-5-8/h2,4,8-9H,3,5-7H2,1H3.
What are the key properties of 2-cyclopent-2-en-1-yl-N-methylethanamine?
2-cyclopent-2-en-1-yl-N-methylethanamine has a molecular weight of 125.21 g/mol, XLogP of 1.56, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopent-2-en-1-yl-N-methylethanamine is sourced from PubChem (CID 15668609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).