2-ethyl-5-methylidenepyrrolidin-1-amine

C7H14N2 — CID 167309498

IUPAC2-ethyl-5-methylidenepyrrolidin-1-amine
SMILESC=C1CCC(CC)N1N
InChIInChI=1S/C7H14N2/c1-3-7-5-4-6(2)9(7)8/h7H,2-5,8H2,1H3
InChIKeyIONNVEMLEBYOBR-UHFFFAOYSA-N
MW126.20 g/mol
LogP1.25
Rot. Bonds1

About 2-ethyl-5-methylidenepyrrolidin-1-amine

2-ethyl-5-methylidenepyrrolidin-1-amine (PubChem CID 167309498) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is 2-ethyl-5-methylidenepyrrolidin-1-amine.

Molecular Properties

Compound Name2-ethyl-5-methylidenepyrrolidin-1-amine
PubChem CID167309498
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name2-ethyl-5-methylidenepyrrolidin-1-amine
SMILESC=C1CCC(CC)N1N
InChIInChI=1S/C7H14N2/c1-3-7-5-4-6(2)9(7)8/h7H,2-5,8H2,1H3
InChIKeyIONNVEMLEBYOBR-UHFFFAOYSA-N
XLogP1.25
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-methylidenepyrrolidin-1-amine?
The IUPAC name of 2-ethyl-5-methylidenepyrrolidin-1-amine (CID 167309498) is 2-ethyl-5-methylidenepyrrolidin-1-amine.
What is the SMILES notation for 2-ethyl-5-methylidenepyrrolidin-1-amine?
The canonical SMILES for 2-ethyl-5-methylidenepyrrolidin-1-amine is C=C1CCC(CC)N1N.
What is the InChIKey of 2-ethyl-5-methylidenepyrrolidin-1-amine?
The InChIKey is IONNVEMLEBYOBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2/c1-3-7-5-4-6(2)9(7)8/h7H,2-5,8H2,1H3.
What are the key properties of 2-ethyl-5-methylidenepyrrolidin-1-amine?
2-ethyl-5-methylidenepyrrolidin-1-amine has a molecular weight of 126.20 g/mol, XLogP of 1.25, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-methylidenepyrrolidin-1-amine is sourced from PubChem (CID 167309498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).