1-but-1-enyl-2-ethylpyrrolidine

C10H19N — CID 175497653

IUPAC1-but-1-enyl-2-ethylpyrrolidine
SMILESCCC=CN1CCCC1CC
InChIInChI=1S/C10H19N/c1-3-5-8-11-9-6-7-10(11)4-2/h5,8,10H,3-4,6-7,9H2,1-2H3
InChIKeyJJVBCJQJMFWERB-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.78
Rot. Bonds3

About 1-but-1-enyl-2-ethylpyrrolidine

1-but-1-enyl-2-ethylpyrrolidine (PubChem CID 175497653) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 1-but-1-enyl-2-ethylpyrrolidine.

Molecular Properties

Compound Name1-but-1-enyl-2-ethylpyrrolidine
PubChem CID175497653
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name1-but-1-enyl-2-ethylpyrrolidine
SMILESCCC=CN1CCCC1CC
InChIInChI=1S/C10H19N/c1-3-5-8-11-9-6-7-10(11)4-2/h5,8,10H,3-4,6-7,9H2,1-2H3
InChIKeyJJVBCJQJMFWERB-UHFFFAOYSA-N
XLogP2.78
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.27
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-but-1-enyl-2-ethylpyrrolidine?
The IUPAC name of 1-but-1-enyl-2-ethylpyrrolidine (CID 175497653) is 1-but-1-enyl-2-ethylpyrrolidine.
What is the SMILES notation for 1-but-1-enyl-2-ethylpyrrolidine?
The canonical SMILES for 1-but-1-enyl-2-ethylpyrrolidine is CCC=CN1CCCC1CC.
What is the InChIKey of 1-but-1-enyl-2-ethylpyrrolidine?
The InChIKey is JJVBCJQJMFWERB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-3-5-8-11-9-6-7-10(11)4-2/h5,8,10H,3-4,6-7,9H2,1-2H3.
What are the key properties of 1-but-1-enyl-2-ethylpyrrolidine?
1-but-1-enyl-2-ethylpyrrolidine has a molecular weight of 153.27 g/mol, XLogP of 2.78, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-but-1-enyl-2-ethylpyrrolidine is sourced from PubChem (CID 175497653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).