1-butyl-2-ethylpyrrolidine

C10H21N — CID 18323959

IUPAC1-butyl-2-ethylpyrrolidine
SMILESCCCCN1CCCC1CC
InChIInChI=1S/C10H21N/c1-3-5-8-11-9-6-7-10(11)4-2/h10H,3-9H2,1-2H3
InChIKeyDIEFUFZFHCAEOO-UHFFFAOYSA-N
MW155.28 g/mol
LogP2.66
Rot. Bonds4

About 1-butyl-2-ethylpyrrolidine

1-butyl-2-ethylpyrrolidine (PubChem CID 18323959) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is 1-butyl-2-ethylpyrrolidine.

Molecular Properties

Compound Name1-butyl-2-ethylpyrrolidine
PubChem CID18323959
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name1-butyl-2-ethylpyrrolidine
SMILESCCCCN1CCCC1CC
InChIInChI=1S/C10H21N/c1-3-5-8-11-9-6-7-10(11)4-2/h10H,3-9H2,1-2H3
InChIKeyDIEFUFZFHCAEOO-UHFFFAOYSA-N
XLogP2.66
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-butyl-2-ethylpyrrolidine?
The IUPAC name of 1-butyl-2-ethylpyrrolidine (CID 18323959) is 1-butyl-2-ethylpyrrolidine.
What is the SMILES notation for 1-butyl-2-ethylpyrrolidine?
The canonical SMILES for 1-butyl-2-ethylpyrrolidine is CCCCN1CCCC1CC.
What is the InChIKey of 1-butyl-2-ethylpyrrolidine?
The InChIKey is DIEFUFZFHCAEOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-3-5-8-11-9-6-7-10(11)4-2/h10H,3-9H2,1-2H3.
What are the key properties of 1-butyl-2-ethylpyrrolidine?
1-butyl-2-ethylpyrrolidine has a molecular weight of 155.28 g/mol, XLogP of 2.66, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-2-ethylpyrrolidine is sourced from PubChem (CID 18323959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).