2-cyclopentyl-2-[2-(oxolan-2-yl)pyrrolidin-1-yl]acetaldehyde

C15H25NO2 — CID 178087244

IUPAC2-cyclopentyl-2-[2-(oxolan-2-yl)pyrrolidin-1-yl]acetaldehyde
SMILESO=CC(C1CCCC1)N1CCCC1C1CCCO1
InChIInChI=1S/C15H25NO2/c17-11-14(12-5-1-2-6-12)16-9-3-7-13(16)15-8-4-10-18-15/h11-15H,1-10H2
InChIKeyBWINPDSTAAPAJC-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.39
Rot. Bonds4

About 2-cyclopentyl-2-[2-(oxolan-2-yl)pyrrolidin-1-yl]acetaldehyde

2-cyclopentyl-2-[2-(oxolan-2-yl)pyrrolidin-1-yl]acetaldehyde (PubChem CID 178087244) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is 2-cyclopentyl-2-[2-(oxolan-2-yl)pyrrolidin-1-yl]acetaldehyde.

Molecular Properties

Compound Name2-cyclopentyl-2-[2-(oxolan-2-yl)pyrrolidin-1-yl]acetaldehyde
PubChem CID178087244
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name2-cyclopentyl-2-[2-(oxolan-2-yl)pyrrolidin-1-yl]acetaldehyde
SMILESO=CC(C1CCCC1)N1CCCC1C1CCCO1
InChIInChI=1S/C15H25NO2/c17-11-14(12-5-1-2-6-12)16-9-3-7-13(16)15-8-4-10-18-15/h11-15H,1-10H2
InChIKeyBWINPDSTAAPAJC-UHFFFAOYSA-N
XLogP2.39
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-2-[2-(oxolan-2-yl)pyrrolidin-1-yl]acetaldehyde?
The IUPAC name of 2-cyclopentyl-2-[2-(oxolan-2-yl)pyrrolidin-1-yl]acetaldehyde (CID 178087244) is 2-cyclopentyl-2-[2-(oxolan-2-yl)pyrrolidin-1-yl]acetaldehyde.
What is the SMILES notation for 2-cyclopentyl-2-[2-(oxolan-2-yl)pyrrolidin-1-yl]acetaldehyde?
The canonical SMILES for 2-cyclopentyl-2-[2-(oxolan-2-yl)pyrrolidin-1-yl]acetaldehyde is O=CC(C1CCCC1)N1CCCC1C1CCCO1.
What is the InChIKey of 2-cyclopentyl-2-[2-(oxolan-2-yl)pyrrolidin-1-yl]acetaldehyde?
The InChIKey is BWINPDSTAAPAJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c17-11-14(12-5-1-2-6-12)16-9-3-7-13(16)15-8-4-10-18-15/h11-15H,1-10H2.
What are the key properties of 2-cyclopentyl-2-[2-(oxolan-2-yl)pyrrolidin-1-yl]acetaldehyde?
2-cyclopentyl-2-[2-(oxolan-2-yl)pyrrolidin-1-yl]acetaldehyde has a molecular weight of 251.37 g/mol, XLogP of 2.39, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-2-[2-(oxolan-2-yl)pyrrolidin-1-yl]acetaldehyde is sourced from PubChem (CID 178087244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).