2-(3-naphthalen-2-ylpyrrolidin-3-yl)ethanol

C16H19NO — CID 18333425

IUPAC2-(3-naphthalen-2-ylpyrrolidin-3-yl)ethanol
SMILESOCCC1(c2ccc3ccccc3c2)CCNC1
InChIInChI=1S/C16H19NO/c18-10-8-16(7-9-17-12-16)15-6-5-13-3-1-2-4-14(13)11-15/h1-6,11,17-18H,7-10,12H2
InChIKeyFEBTXRVHZYFZLS-UHFFFAOYSA-N
MW241.33 g/mol
LogP2.45
Rot. Bonds3

About 2-(3-naphthalen-2-ylpyrrolidin-3-yl)ethanol

2-(3-naphthalen-2-ylpyrrolidin-3-yl)ethanol (PubChem CID 18333425) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-(3-naphthalen-2-ylpyrrolidin-3-yl)ethanol.

Molecular Properties

Compound Name2-(3-naphthalen-2-ylpyrrolidin-3-yl)ethanol
PubChem CID18333425
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name2-(3-naphthalen-2-ylpyrrolidin-3-yl)ethanol
SMILESOCCC1(c2ccc3ccccc3c2)CCNC1
InChIInChI=1S/C16H19NO/c18-10-8-16(7-9-17-12-16)15-6-5-13-3-1-2-4-14(13)11-15/h1-6,11,17-18H,7-10,12H2
InChIKeyFEBTXRVHZYFZLS-UHFFFAOYSA-N
XLogP2.45
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3-naphthalen-2-ylpyrrolidin-3-yl)ethanol?
The IUPAC name of 2-(3-naphthalen-2-ylpyrrolidin-3-yl)ethanol (CID 18333425) is 2-(3-naphthalen-2-ylpyrrolidin-3-yl)ethanol.
What is the SMILES notation for 2-(3-naphthalen-2-ylpyrrolidin-3-yl)ethanol?
The canonical SMILES for 2-(3-naphthalen-2-ylpyrrolidin-3-yl)ethanol is OCCC1(c2ccc3ccccc3c2)CCNC1.
What is the InChIKey of 2-(3-naphthalen-2-ylpyrrolidin-3-yl)ethanol?
The InChIKey is FEBTXRVHZYFZLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c18-10-8-16(7-9-17-12-16)15-6-5-13-3-1-2-4-14(13)11-15/h1-6,11,17-18H,7-10,12H2.
What are the key properties of 2-(3-naphthalen-2-ylpyrrolidin-3-yl)ethanol?
2-(3-naphthalen-2-ylpyrrolidin-3-yl)ethanol has a molecular weight of 241.33 g/mol, XLogP of 2.45, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-naphthalen-2-ylpyrrolidin-3-yl)ethanol is sourced from PubChem (CID 18333425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).