1-(2-ethylbut-1-enyl)pyrrolidine

C10H19N — CID 3050563

IUPAC1-(2-ethylbut-1-enyl)pyrrolidine
SMILESCCC(=CN1CCCC1)CC
InChIInChI=1S/C10H19N/c1-3-10(4-2)9-11-7-5-6-8-11/h9H,3-8H2,1-2H3
InChIKeyNMCUYNPUEJQBIW-UHFFFAOYSA-N
MW153.27 g/mol
LogP2.79
Rot. Bonds3

About 1-(2-ethylbut-1-enyl)pyrrolidine

1-(2-ethylbut-1-enyl)pyrrolidine (PubChem CID 3050563) has the molecular formula C10H19N and a molecular weight of 153.27 g/mol. Its IUPAC name is 1-(2-ethylbut-1-enyl)pyrrolidine.

Molecular Properties

Compound Name1-(2-ethylbut-1-enyl)pyrrolidine
PubChem CID3050563
Molecular FormulaC10H19N
Molecular Weight153.27 g/mol
Exact Mass153.15
IUPAC Name1-(2-ethylbut-1-enyl)pyrrolidine
SMILESCCC(=CN1CCCC1)CC
InChIInChI=1S/C10H19N/c1-3-10(4-2)9-11-7-5-6-8-11/h9H,3-8H2,1-2H3
InChIKeyNMCUYNPUEJQBIW-UHFFFAOYSA-N
XLogP2.79
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 ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylbut-1-enyl)pyrrolidine?
The IUPAC name of 1-(2-ethylbut-1-enyl)pyrrolidine (CID 3050563) is 1-(2-ethylbut-1-enyl)pyrrolidine.
What is the SMILES notation for 1-(2-ethylbut-1-enyl)pyrrolidine?
The canonical SMILES for 1-(2-ethylbut-1-enyl)pyrrolidine is CCC(=CN1CCCC1)CC.
What is the InChIKey of 1-(2-ethylbut-1-enyl)pyrrolidine?
The InChIKey is NMCUYNPUEJQBIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N/c1-3-10(4-2)9-11-7-5-6-8-11/h9H,3-8H2,1-2H3.
What are the key properties of 1-(2-ethylbut-1-enyl)pyrrolidine?
1-(2-ethylbut-1-enyl)pyrrolidine has a molecular weight of 153.27 g/mol, XLogP of 2.79, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylbut-1-enyl)pyrrolidine is sourced from PubChem (CID 3050563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).