3-(2-naphthalen-1-ylethyl)pyrrolidine

C16H19N — CID 116925512

IUPAC3-(2-naphthalen-1-ylethyl)pyrrolidine
SMILESc1ccc2c(CCC3CCNC3)cccc2c1
InChIInChI=1S/C16H19N/c1-2-7-16-14(4-1)5-3-6-15(16)9-8-13-10-11-17-12-13/h1-7,13,17H,8-12H2
InChIKeyVFIILPSQGCFZSC-UHFFFAOYSA-N
MW225.34 g/mol
LogP3.38
Rot. Bonds3

About 3-(2-naphthalen-1-ylethyl)pyrrolidine

3-(2-naphthalen-1-ylethyl)pyrrolidine (PubChem CID 116925512) has the molecular formula C16H19N and a molecular weight of 225.34 g/mol. Its IUPAC name is 3-(2-naphthalen-1-ylethyl)pyrrolidine.

Molecular Properties

Compound Name3-(2-naphthalen-1-ylethyl)pyrrolidine
PubChem CID116925512
Molecular FormulaC16H19N
Molecular Weight225.34 g/mol
Exact Mass225.15
IUPAC Name3-(2-naphthalen-1-ylethyl)pyrrolidine
SMILESc1ccc2c(CCC3CCNC3)cccc2c1
InChIInChI=1S/C16H19N/c1-2-7-16-14(4-1)5-3-6-15(16)9-8-13-10-11-17-12-13/h1-7,13,17H,8-12H2
InChIKeyVFIILPSQGCFZSC-UHFFFAOYSA-N
XLogP3.38
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-(2-naphthalen-1-ylethyl)pyrrolidine 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

N-(naphthalen-1-ylmethyl)-2-piperidin-4-ylethanamine
CID 115211649
2-naphthalen-1-yl-N-(piperidin-3-ylmethyl)ethanamine
CID 115209720
N-(2-naphthalen-1-ylethyl)piperidin-4-amine
CID 115118495
2-(pyrrolidin-3-ylmethyl)phenol
CID 82599560
4-(naphthalen-1-ylmethoxy)piperidine
CID 13194444
7-(pyrrolidin-3-ylmethyl)-1H-indole
CID 84775916
3-[(2-chloro-3-fluorophenyl)methyl]pyrrolidine
CID 84783122
4-(2-naphthalen-1-yloxyethyl)piperidine;hydrochloride
CID 75539369
(3R)-3-[2-[(3R)-pyrrolidin-3-yl]ethyl]pyrrolidine
CID 129415517
4-[3-(7-methylnaphthalen-1-yl)propyl]piperidine
CID 58227815
3-[(7-methoxynaphthalen-1-yl)methyl]pyrrolidine
CID 19096229
3-[2-(4-tert-butyl-2-methylphenyl)ethyl]pyrrolidine
CID 116925484

Frequently Asked Questions

What is the IUPAC name of 3-(2-naphthalen-1-ylethyl)pyrrolidine?
The IUPAC name of 3-(2-naphthalen-1-ylethyl)pyrrolidine (CID 116925512) is 3-(2-naphthalen-1-ylethyl)pyrrolidine.
What is the SMILES notation for 3-(2-naphthalen-1-ylethyl)pyrrolidine?
The canonical SMILES for 3-(2-naphthalen-1-ylethyl)pyrrolidine is c1ccc2c(CCC3CCNC3)cccc2c1.
What is the InChIKey of 3-(2-naphthalen-1-ylethyl)pyrrolidine?
The InChIKey is VFIILPSQGCFZSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N/c1-2-7-16-14(4-1)5-3-6-15(16)9-8-13-10-11-17-12-13/h1-7,13,17H,8-12H2.
What are the key properties of 3-(2-naphthalen-1-ylethyl)pyrrolidine?
3-(2-naphthalen-1-ylethyl)pyrrolidine has a molecular weight of 225.34 g/mol, XLogP of 3.38, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-naphthalen-1-ylethyl)pyrrolidine is sourced from PubChem (CID 116925512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).