2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridine

C17H20N2O — CID 91805558

IUPAC2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridine
SMILESc1ccc(-c2ccc(OCCN3CCCC3)cc2)nc1
InChIInChI=1S/C17H20N2O/c1-2-10-18-17(5-1)15-6-8-16(9-7-15)20-14-13-19-11-3-4-12-19/h1-2,5-10H,3-4,11-14H2
InChIKeyODWUGADMCOBVJQ-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.22
Rot. Bonds5

About 2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridine

2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridine (PubChem CID 91805558) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridine.

Molecular Properties

Compound Name2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridine
PubChem CID91805558
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridine
SMILESc1ccc(-c2ccc(OCCN3CCCC3)cc2)nc1
InChIInChI=1S/C17H20N2O/c1-2-10-18-17(5-1)15-6-8-16(9-7-15)20-14-13-19-11-3-4-12-19/h1-2,5-10H,3-4,11-14H2
InChIKeyODWUGADMCOBVJQ-UHFFFAOYSA-N
XLogP3.22
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(4-phenylphenoxy)ethyl]piperidine
CID 58483683
2-[2-ethoxy-4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridine
CID 174733983
1,4-bis(2-phenoxyethyl)-1,4-diazepane
CID 58861609
1-[3-(4-phenylphenoxy)propyl]piperidine
CID 56683751
3-[2-[4-(2-piperidin-1-ylethoxy)phenyl]-4-pyridinyl]pyrazolo[1,5-a]pyrimidine
CID 174231173
1-[5-(4-phenylphenoxy)pentyl]pyrrolidine
CID 11857856
4-(5-pyridin-2-yl-1H-pyrazol-4-yl)-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridin-2-amine
CID 10159518
1-[2-(4-ethoxyphenoxy)ethyl]pyrrolidine
CID 803619
1-[6-(4-phenylphenoxy)hexyl]piperidine
CID 155533744
2-methyl-6-[5-[2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-3-pyridinyl]-2H-triazol-4-yl]pyridine
CID 66679301
1-[2-(4-methoxyphenoxy)ethyl]azepane
CID 888209
5-(2-phenoxyethylsulfanylmethyl)-3-[4-(2-pyrrolidin-1-ylethoxy)phenyl]-1,2-oxazole
CID 21108852

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridine?
The IUPAC name of 2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridine (CID 91805558) is 2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridine.
What is the SMILES notation for 2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridine?
The canonical SMILES for 2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridine is c1ccc(-c2ccc(OCCN3CCCC3)cc2)nc1.
What is the InChIKey of 2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridine?
The InChIKey is ODWUGADMCOBVJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-2-10-18-17(5-1)15-6-8-16(9-7-15)20-14-13-19-11-3-4-12-19/h1-2,5-10H,3-4,11-14H2.
What are the key properties of 2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridine?
2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridine has a molecular weight of 268.36 g/mol, XLogP of 3.22, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-pyrrolidin-1-ylethoxy)phenyl]pyridine is sourced from PubChem (CID 91805558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).