1-[(1R)-1-naphthalen-1-ylethyl]pyrrolidin-2-one

C16H17NO — CID 162354731

IUPAC1-[(1R)-1-naphthalen-1-ylethyl]pyrrolidin-2-one
SMILESC[C@H](c1cccc2ccccc12)N1CCCC1=O
InChIInChI=1S/C16H17NO/c1-12(17-11-5-10-16(17)18)14-9-4-7-13-6-2-3-8-15(13)14/h2-4,6-9,12H,5,10-11H2,1H3/t12-/m1/s1
InChIKeyVXQYGJWNDKPQFL-GFCCVEGCSA-N
MW239.32 g/mol
LogP3.52
Rot. Bonds2

About 1-[(1R)-1-naphthalen-1-ylethyl]pyrrolidin-2-one

1-[(1R)-1-naphthalen-1-ylethyl]pyrrolidin-2-one (PubChem CID 162354731) has the molecular formula C16H17NO and a molecular weight of 239.32 g/mol. Its IUPAC name is 1-[(1R)-1-naphthalen-1-ylethyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-[(1R)-1-naphthalen-1-ylethyl]pyrrolidin-2-one
PubChem CID162354731
Molecular FormulaC16H17NO
Molecular Weight239.32 g/mol
Exact Mass239.13
IUPAC Name1-[(1R)-1-naphthalen-1-ylethyl]pyrrolidin-2-one
SMILESC[C@H](c1cccc2ccccc12)N1CCCC1=O
InChIInChI=1S/C16H17NO/c1-12(17-11-5-10-16(17)18)14-9-4-7-13-6-2-3-8-15(13)14/h2-4,6-9,12H,5,10-11H2,1H3/t12-/m1/s1
InChIKeyVXQYGJWNDKPQFL-GFCCVEGCSA-N
XLogP3.52
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-[(1R)-1-naphthalen-1-ylethyl]pyrrolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(1-naphthalen-1-ylethyl)-4-(sulfanylmethyl)pyrrolidin-2-one
CID 168669260
4-(aminomethyl)-1-(1-naphthalen-1-ylethyl)pyrrolidin-2-one
CID 168658813
1-[(1R)-1-naphthalen-1-ylethyl]-3,4-dihydro-2H-pyridine-5-carboxamide
CID 101060850
1-[(2-methoxyphenyl)-(2-oxopyrrolidin-1-yl)methyl]pyrrolidin-2-one
CID 102530470
S-[[1-[(1S)-1-naphthalen-1-ylethyl]-5-oxopyrrolidin-3-yl]methyl] ethanethioate
CID 168666024
1-[1-(4-fluorophenyl)-2-naphthalen-1-ylethyl]pyrrolidin-2-one
CID 143373011
(2R)-3-naphthalen-1-yl-2-(2-oxopiperidin-1-yl)propanal
CID 22860991
1-[(2-chlorophenyl)-(2-oxopyrrolidin-1-yl)methyl]pyrrolidin-2-one
CID 102530474
1-[(1R)-1-naphthalen-1-ylethyl]piperidine-4-carboxylic acid
CID 155289856
3-[(1R)-1-naphthalen-1-ylethyl]-1-[(1S)-1-naphthalen-1-ylethyl]-2,4-dihydroquinazoline
CID 71049444
1-(1-naphthalen-1-ylethyl)azetidin-3-ol
CID 23381710
1-[(1R)-1-[[(1R)-1-naphthalen-1-ylethyl]disulfanyl]ethyl]naphthalene
CID 131854345

Frequently Asked Questions

What is the IUPAC name of 1-[(1R)-1-naphthalen-1-ylethyl]pyrrolidin-2-one?
The IUPAC name of 1-[(1R)-1-naphthalen-1-ylethyl]pyrrolidin-2-one (CID 162354731) is 1-[(1R)-1-naphthalen-1-ylethyl]pyrrolidin-2-one.
What is the SMILES notation for 1-[(1R)-1-naphthalen-1-ylethyl]pyrrolidin-2-one?
The canonical SMILES for 1-[(1R)-1-naphthalen-1-ylethyl]pyrrolidin-2-one is C[C@H](c1cccc2ccccc12)N1CCCC1=O.
What is the InChIKey of 1-[(1R)-1-naphthalen-1-ylethyl]pyrrolidin-2-one?
The InChIKey is VXQYGJWNDKPQFL-GFCCVEGCSA-N. The full InChI is InChI=1S/C16H17NO/c1-12(17-11-5-10-16(17)18)14-9-4-7-13-6-2-3-8-15(13)14/h2-4,6-9,12H,5,10-11H2,1H3/t12-/m1/s1.
What are the key properties of 1-[(1R)-1-naphthalen-1-ylethyl]pyrrolidin-2-one?
1-[(1R)-1-naphthalen-1-ylethyl]pyrrolidin-2-one has a molecular weight of 239.32 g/mol, XLogP of 3.52, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(1R)-1-naphthalen-1-ylethyl]pyrrolidin-2-one is sourced from PubChem (CID 162354731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).