1-(2-naphthalen-2-yloxyethyl)pyrrolidin-2-one

C16H17NO2 — CID 82132102

IUPAC1-(2-naphthalen-2-yloxyethyl)pyrrolidin-2-one
SMILESO=C1CCCN1CCOc1ccc2ccccc2c1
InChIInChI=1S/C16H17NO2/c18-16-6-3-9-17(16)10-11-19-15-8-7-13-4-1-2-5-14(13)12-15/h1-2,4-5,7-8,12H,3,6,9-11H2
InChIKeyNJJQJTWVLKSEET-UHFFFAOYSA-N
MW255.32 g/mol
LogP2.84
Rot. Bonds4

About 1-(2-naphthalen-2-yloxyethyl)pyrrolidin-2-one

1-(2-naphthalen-2-yloxyethyl)pyrrolidin-2-one (PubChem CID 82132102) has the molecular formula C16H17NO2 and a molecular weight of 255.32 g/mol. Its IUPAC name is 1-(2-naphthalen-2-yloxyethyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-(2-naphthalen-2-yloxyethyl)pyrrolidin-2-one
PubChem CID82132102
Molecular FormulaC16H17NO2
Molecular Weight255.32 g/mol
Exact Mass255.13
IUPAC Name1-(2-naphthalen-2-yloxyethyl)pyrrolidin-2-one
SMILESO=C1CCCN1CCOc1ccc2ccccc2c1
InChIInChI=1S/C16H17NO2/c18-16-6-3-9-17(16)10-11-19-15-8-7-13-4-1-2-5-14(13)12-15/h1-2,4-5,7-8,12H,3,6,9-11H2
InChIKeyNJJQJTWVLKSEET-UHFFFAOYSA-N
XLogP2.84
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-naphthalen-2-yloxyethyl)pyrrolidin-2-one?
The IUPAC name of 1-(2-naphthalen-2-yloxyethyl)pyrrolidin-2-one (CID 82132102) is 1-(2-naphthalen-2-yloxyethyl)pyrrolidin-2-one.
What is the SMILES notation for 1-(2-naphthalen-2-yloxyethyl)pyrrolidin-2-one?
The canonical SMILES for 1-(2-naphthalen-2-yloxyethyl)pyrrolidin-2-one is O=C1CCCN1CCOc1ccc2ccccc2c1.
What is the InChIKey of 1-(2-naphthalen-2-yloxyethyl)pyrrolidin-2-one?
The InChIKey is NJJQJTWVLKSEET-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO2/c18-16-6-3-9-17(16)10-11-19-15-8-7-13-4-1-2-5-14(13)12-15/h1-2,4-5,7-8,12H,3,6,9-11H2.
What are the key properties of 1-(2-naphthalen-2-yloxyethyl)pyrrolidin-2-one?
1-(2-naphthalen-2-yloxyethyl)pyrrolidin-2-one has a molecular weight of 255.32 g/mol, XLogP of 2.84, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-naphthalen-2-yloxyethyl)pyrrolidin-2-one is sourced from PubChem (CID 82132102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).