2-ethyl-N-methylcyclopent-2-en-1-amine

C8H15N — CID 123512863

IUPAC2-ethyl-N-methylcyclopent-2-en-1-amine
SMILESCCC1=CCCC1NC
InChIInChI=1S/C8H15N/c1-3-7-5-4-6-8(7)9-2/h5,8-9H,3-4,6H2,1-2H3
InChIKeyBAFZIHRNRSULQO-UHFFFAOYSA-N
MW125.21 g/mol
LogP1.70
Rot. Bonds2

About 2-ethyl-N-methylcyclopent-2-en-1-amine

2-ethyl-N-methylcyclopent-2-en-1-amine (PubChem CID 123512863) has the molecular formula C8H15N and a molecular weight of 125.21 g/mol. Its IUPAC name is 2-ethyl-N-methylcyclopent-2-en-1-amine.

Molecular Properties

Compound Name2-ethyl-N-methylcyclopent-2-en-1-amine
PubChem CID123512863
Molecular FormulaC8H15N
Molecular Weight125.21 g/mol
Exact Mass125.12
IUPAC Name2-ethyl-N-methylcyclopent-2-en-1-amine
SMILESCCC1=CCCC1NC
InChIInChI=1S/C8H15N/c1-3-7-5-4-6-8(7)9-2/h5,8-9H,3-4,6H2,1-2H3
InChIKeyBAFZIHRNRSULQO-UHFFFAOYSA-N
XLogP1.70
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.21
LogP ≤ 51.70
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-ethyl-N-methylcyclopent-2-en-1-amine?
The IUPAC name of 2-ethyl-N-methylcyclopent-2-en-1-amine (CID 123512863) is 2-ethyl-N-methylcyclopent-2-en-1-amine.
What is the SMILES notation for 2-ethyl-N-methylcyclopent-2-en-1-amine?
The canonical SMILES for 2-ethyl-N-methylcyclopent-2-en-1-amine is CCC1=CCCC1NC.
What is the InChIKey of 2-ethyl-N-methylcyclopent-2-en-1-amine?
The InChIKey is BAFZIHRNRSULQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N/c1-3-7-5-4-6-8(7)9-2/h5,8-9H,3-4,6H2,1-2H3.
What are the key properties of 2-ethyl-N-methylcyclopent-2-en-1-amine?
2-ethyl-N-methylcyclopent-2-en-1-amine has a molecular weight of 125.21 g/mol, XLogP of 1.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-methylcyclopent-2-en-1-amine is sourced from PubChem (CID 123512863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).