2-[2-(2-pyrrolidin-1-ylphenyl)ethyl]pyridine

C17H20N2 — CID 168512294

IUPAC2-[2-(2-pyrrolidin-1-ylphenyl)ethyl]pyridine
SMILESc1ccc(CCc2ccccc2N2CCCC2)nc1
InChIInChI=1S/C17H20N2/c1-2-9-17(19-13-5-6-14-19)15(7-1)10-11-16-8-3-4-12-18-16/h1-4,7-9,12H,5-6,10-11,13-14H2
InChIKeyOVWPNGPNIHXJOQ-UHFFFAOYSA-N
MW252.36 g/mol
LogP3.47
Rot. Bonds4

About 2-[2-(2-pyrrolidin-1-ylphenyl)ethyl]pyridine

2-[2-(2-pyrrolidin-1-ylphenyl)ethyl]pyridine (PubChem CID 168512294) has the molecular formula C17H20N2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 2-[2-(2-pyrrolidin-1-ylphenyl)ethyl]pyridine.

Molecular Properties

Compound Name2-[2-(2-pyrrolidin-1-ylphenyl)ethyl]pyridine
PubChem CID168512294
Molecular FormulaC17H20N2
Molecular Weight252.36 g/mol
Exact Mass252.16
IUPAC Name2-[2-(2-pyrrolidin-1-ylphenyl)ethyl]pyridine
SMILESc1ccc(CCc2ccccc2N2CCCC2)nc1
InChIInChI=1S/C17H20N2/c1-2-9-17(19-13-5-6-14-19)15(7-1)10-11-16-8-3-4-12-18-16/h1-4,7-9,12H,5-6,10-11,13-14H2
InChIKeyOVWPNGPNIHXJOQ-UHFFFAOYSA-N
XLogP3.47
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-(2-pyridin-2-ylethyl)phenyl]isoindole-1,3-dione
CID 168516332
(1S)-1-pyridin-2-yl-N-[(2-pyrrolidin-1-ylphenyl)methyl]ethanamine
CID 78979013
1-(2-pyridin-2-ylethyl)diazinane
CID 130826026
1-pyridazin-3-yl-N-[(2-pyrrolidin-1-ylphenyl)methyl]methanamine
CID 106834182
3-(2-piperidin-1-ylphenyl)propanenitrile;hydrochloride
CID 67111375
2-(2-pyridin-2-ylethyl)benzoic acid;hydrochloride
CID 45075115
2-[2-[[4-(2-chlorophenyl)-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl]sulfanyl]ethyl]pyridine
CID 46691852
3-pyridin-2-yl-1-pyrrolidin-1-ylpropan-1-one
CID 84583378
2-pyridin-2-yl-1-(4-pyrrolidin-1-ylphenyl)ethanone
CID 10611815
1-[2-(2,2-dimethylpropyl)phenyl]pyrrolidine
CID 129255508
2-[(2-pyrrolidin-1-ylphenyl)methyl]phenol
CID 13201564
1-[2-(2-piperidin-1-ylphenyl)ethyl]piperazine
CID 117436771

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-pyrrolidin-1-ylphenyl)ethyl]pyridine?
The IUPAC name of 2-[2-(2-pyrrolidin-1-ylphenyl)ethyl]pyridine (CID 168512294) is 2-[2-(2-pyrrolidin-1-ylphenyl)ethyl]pyridine.
What is the SMILES notation for 2-[2-(2-pyrrolidin-1-ylphenyl)ethyl]pyridine?
The canonical SMILES for 2-[2-(2-pyrrolidin-1-ylphenyl)ethyl]pyridine is c1ccc(CCc2ccccc2N2CCCC2)nc1.
What is the InChIKey of 2-[2-(2-pyrrolidin-1-ylphenyl)ethyl]pyridine?
The InChIKey is OVWPNGPNIHXJOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2/c1-2-9-17(19-13-5-6-14-19)15(7-1)10-11-16-8-3-4-12-18-16/h1-4,7-9,12H,5-6,10-11,13-14H2.
What are the key properties of 2-[2-(2-pyrrolidin-1-ylphenyl)ethyl]pyridine?
2-[2-(2-pyrrolidin-1-ylphenyl)ethyl]pyridine has a molecular weight of 252.36 g/mol, XLogP of 3.47, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-pyrrolidin-1-ylphenyl)ethyl]pyridine is sourced from PubChem (CID 168512294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).