5-(1-methylpyrrolidin-2-yl)-2-(2-phenylethyl)pyridine

C18H22N2 — CID 11644688

IUPAC5-(1-methylpyrrolidin-2-yl)-2-(2-phenylethyl)pyridine
SMILESCN1CCCC1c1ccc(CCc2ccccc2)nc1
InChIInChI=1S/C18H22N2/c1-20-13-5-8-18(20)16-10-12-17(19-14-16)11-9-15-6-3-2-4-7-15/h2-4,6-7,10,12,14,18H,5,8-9,11,13H2,1H3
InChIKeyYJFYNYHEHYBROJ-UHFFFAOYSA-N
MW266.39 g/mol
LogP3.63
Rot. Bonds4

About 5-(1-methylpyrrolidin-2-yl)-2-(2-phenylethyl)pyridine

5-(1-methylpyrrolidin-2-yl)-2-(2-phenylethyl)pyridine (PubChem CID 11644688) has the molecular formula C18H22N2 and a molecular weight of 266.39 g/mol. Its IUPAC name is 5-(1-methylpyrrolidin-2-yl)-2-(2-phenylethyl)pyridine.

Molecular Properties

Compound Name5-(1-methylpyrrolidin-2-yl)-2-(2-phenylethyl)pyridine
PubChem CID11644688
Molecular FormulaC18H22N2
Molecular Weight266.39 g/mol
Exact Mass266.18
IUPAC Name5-(1-methylpyrrolidin-2-yl)-2-(2-phenylethyl)pyridine
SMILESCN1CCCC1c1ccc(CCc2ccccc2)nc1
InChIInChI=1S/C18H22N2/c1-20-13-5-8-18(20)16-10-12-17(19-14-16)11-9-15-6-3-2-4-7-15/h2-4,6-7,10,12,14,18H,5,8-9,11,13H2,1H3
InChIKeyYJFYNYHEHYBROJ-UHFFFAOYSA-N
XLogP3.63
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 53.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Nicotine
CID 89594
(+-)-Chlorpheniramine
CID 2725
Triprolidine
CID 5282443
Brompheniramine
CID 6834
Anabasine
CID 205586
(+-)-Dimethindene
CID 21855
Nornicotine
CID 91462
Dexchlorpheniramine
CID 33036
3-(1-Methylpyrrolidin-2-yl)pyridine
CID 942
Pheniramine
CID 4761
Prothionamide
CID 666418
Zimelidine
CID 5365247

Frequently Asked Questions

What is the IUPAC name of 5-(1-methylpyrrolidin-2-yl)-2-(2-phenylethyl)pyridine?
The IUPAC name of 5-(1-methylpyrrolidin-2-yl)-2-(2-phenylethyl)pyridine (CID 11644688) is 5-(1-methylpyrrolidin-2-yl)-2-(2-phenylethyl)pyridine.
What is the SMILES notation for 5-(1-methylpyrrolidin-2-yl)-2-(2-phenylethyl)pyridine?
The canonical SMILES for 5-(1-methylpyrrolidin-2-yl)-2-(2-phenylethyl)pyridine is CN1CCCC1c1ccc(CCc2ccccc2)nc1.
What is the InChIKey of 5-(1-methylpyrrolidin-2-yl)-2-(2-phenylethyl)pyridine?
The InChIKey is YJFYNYHEHYBROJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2/c1-20-13-5-8-18(20)16-10-12-17(19-14-16)11-9-15-6-3-2-4-7-15/h2-4,6-7,10,12,14,18H,5,8-9,11,13H2,1H3.
What are the key properties of 5-(1-methylpyrrolidin-2-yl)-2-(2-phenylethyl)pyridine?
5-(1-methylpyrrolidin-2-yl)-2-(2-phenylethyl)pyridine has a molecular weight of 266.39 g/mol, XLogP of 3.63, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylpyrrolidin-2-yl)-2-(2-phenylethyl)pyridine is sourced from PubChem (CID 11644688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).