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

C16H19NO — CID 59544011

IUPAC3-(1-naphthalen-2-yloxyethyl)pyrrolidine
SMILESCC(Oc1ccc2ccccc2c1)C1CCNC1
InChIInChI=1S/C16H19NO/c1-12(15-8-9-17-11-15)18-16-7-6-13-4-2-3-5-14(13)10-16/h2-7,10,12,15,17H,8-9,11H2,1H3
InChIKeyDMJVPZTZANGKQI-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.22
Rot. Bonds3

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

3-(1-naphthalen-2-yloxyethyl)pyrrolidine (PubChem CID 59544011) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 3-(1-naphthalen-2-yloxyethyl)pyrrolidine.

Molecular Properties

Compound Name3-(1-naphthalen-2-yloxyethyl)pyrrolidine
PubChem CID59544011
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name3-(1-naphthalen-2-yloxyethyl)pyrrolidine
SMILESCC(Oc1ccc2ccccc2c1)C1CCNC1
InChIInChI=1S/C16H19NO/c1-12(15-8-9-17-11-15)18-16-7-6-13-4-2-3-5-14(13)10-16/h2-7,10,12,15,17H,8-9,11H2,1H3
InChIKeyDMJVPZTZANGKQI-UHFFFAOYSA-N
XLogP3.22
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[1-(3-methoxyphenoxy)ethyl]pyrrolidine
CID 105477836
6-(1-piperidin-4-ylethoxy)quinoline
CID 117051472
3-(1-phenoxyethyl)azetidine
CID 105437140
4-(6-propan-2-yloxynaphthalen-2-yl)piperidine
CID 146675177
4-[1-(2-methoxyphenoxy)ethyl]piperidine
CID 105496691
3-[(1S)-1-(3-fluorophenoxy)-2-methylpropyl]pyrrolidine
CID 66848319
N-(1-piperidin-4-ylethyl)naphthalene-2-carboxamide
CID 43523229
3-methyl-4-naphthalen-2-ylpiperidine
CID 66277961
3-[1-(azetidin-3-yl)ethoxy]phenol
CID 105447139
2-(4-propan-2-ylcyclohexyl)oxynaphthalene
CID 141348691
3-methyl-4-(3-propan-2-yloxyphenyl)piperidine
CID 79320306
4-[1-(3,5-difluorophenoxy)ethyl]piperidine
CID 117051139

Frequently Asked Questions

What is the IUPAC name of 3-(1-naphthalen-2-yloxyethyl)pyrrolidine?
The IUPAC name of 3-(1-naphthalen-2-yloxyethyl)pyrrolidine (CID 59544011) is 3-(1-naphthalen-2-yloxyethyl)pyrrolidine.
What is the SMILES notation for 3-(1-naphthalen-2-yloxyethyl)pyrrolidine?
The canonical SMILES for 3-(1-naphthalen-2-yloxyethyl)pyrrolidine is CC(Oc1ccc2ccccc2c1)C1CCNC1.
What is the InChIKey of 3-(1-naphthalen-2-yloxyethyl)pyrrolidine?
The InChIKey is DMJVPZTZANGKQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-12(15-8-9-17-11-15)18-16-7-6-13-4-2-3-5-14(13)10-16/h2-7,10,12,15,17H,8-9,11H2,1H3.
What are the key properties of 3-(1-naphthalen-2-yloxyethyl)pyrrolidine?
3-(1-naphthalen-2-yloxyethyl)pyrrolidine has a molecular weight of 241.33 g/mol, XLogP of 3.22, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-naphthalen-2-yloxyethyl)pyrrolidine is sourced from PubChem (CID 59544011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).