1-ethylpyrazolidine

C5H12N2 — CID 12612930

IUPAC1-ethylpyrazolidine
SMILESCCN1CCCN1
InChIInChI=1S/C5H12N2/c1-2-7-5-3-4-6-7/h6H,2-5H2,1H3
InChIKeyKFMUXFQJUKRXFB-UHFFFAOYSA-N
MW100.17 g/mol
LogP0.22
Rot. Bonds1

About 1-ethylpyrazolidine

1-ethylpyrazolidine (PubChem CID 12612930) has the molecular formula C5H12N2 and a molecular weight of 100.17 g/mol. Its IUPAC name is 1-ethylpyrazolidine.

Molecular Properties

Compound Name1-ethylpyrazolidine
PubChem CID12612930
Molecular FormulaC5H12N2
Molecular Weight100.17 g/mol
Exact Mass100.10
IUPAC Name1-ethylpyrazolidine
SMILESCCN1CCCN1
InChIInChI=1S/C5H12N2/c1-2-7-5-3-4-6-7/h6H,2-5H2,1H3
InChIKeyKFMUXFQJUKRXFB-UHFFFAOYSA-N
XLogP0.22
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.17
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethylpyrazolidine?
The IUPAC name of 1-ethylpyrazolidine (CID 12612930) is 1-ethylpyrazolidine.
What is the SMILES notation for 1-ethylpyrazolidine?
The canonical SMILES for 1-ethylpyrazolidine is CCN1CCCN1.
What is the InChIKey of 1-ethylpyrazolidine?
The InChIKey is KFMUXFQJUKRXFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2/c1-2-7-5-3-4-6-7/h6H,2-5H2,1H3.
What are the key properties of 1-ethylpyrazolidine?
1-ethylpyrazolidine has a molecular weight of 100.17 g/mol, XLogP of 0.22, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethylpyrazolidine is sourced from PubChem (CID 12612930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).