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

C17H20N2 — CID 51039568

IUPAC2-(1-benzyl-5-methylpyrrolidin-2-yl)pyridine
SMILESCC1CCC(c2ccccn2)N1Cc1ccccc1
InChIInChI=1S/C17H20N2/c1-14-10-11-17(16-9-5-6-12-18-16)19(14)13-15-7-3-2-4-8-15/h2-9,12,14,17H,10-11,13H2,1H3
InChIKeyVDQSUFJUNNMQGL-UHFFFAOYSA-N
MW252.36 g/mol
LogP3.81
Rot. Bonds3

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

2-(1-benzyl-5-methylpyrrolidin-2-yl)pyridine (PubChem CID 51039568) has the molecular formula C17H20N2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 2-(1-benzyl-5-methylpyrrolidin-2-yl)pyridine.

Molecular Properties

Compound Name2-(1-benzyl-5-methylpyrrolidin-2-yl)pyridine
PubChem CID51039568
Molecular FormulaC17H20N2
Molecular Weight252.36 g/mol
Exact Mass252.16
IUPAC Name2-(1-benzyl-5-methylpyrrolidin-2-yl)pyridine
SMILESCC1CCC(c2ccccn2)N1Cc1ccccc1
InChIInChI=1S/C17H20N2/c1-14-10-11-17(16-9-5-6-12-18-16)19(14)13-15-7-3-2-4-8-15/h2-9,12,14,17H,10-11,13H2,1H3
InChIKeyVDQSUFJUNNMQGL-UHFFFAOYSA-N
XLogP3.81
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2R,5S)-1,2-dibenzyl-5-methylpyrrolidine
CID 101143886
2-(1,3-dibenzylimidazolidin-2-yl)pyridine
CID 11370900
2-[(2S,6R)-1-benzyl-2,6-dimethylpiperidin-3-yl]ethanamine
CID 83488247
2-[(2S)-1-(pyridin-3-ylmethyl)pyrrolidin-2-yl]pyridine
CID 95841459
2-[(2S)-1-[(4-methylsulfonylphenyl)methyl]pyrrolidin-2-yl]pyridine
CID 99937922
2-pyridin-2-yl-5-[(2-pyridin-2-ylpyrrolidin-1-yl)methyl]pyrimidine
CID 56714022
1-benzyl-2,4,6-trimethylpiperazine;ethane
CID 145145850
7-benzyl-7-azabicyclo[2.2.1]heptan-2-one
CID 83679878
2-[(2R)-1-[(1-methylpyrazol-4-yl)methyl]pyrrolidin-2-yl]pyridine
CID 95730792
4-(1-benzylpyrrolidin-2-yl)pyrimidine
CID 175656203
2-[1-(azetidin-3-ylmethyl)-6-pyridin-2-ylpiperidin-2-yl]pyridine
CID 67421842
2-(2-pyridin-2-ylpyrrolidin-1-yl)acetic acid
CID 131863720

Frequently Asked Questions

What is the IUPAC name of 2-(1-benzyl-5-methylpyrrolidin-2-yl)pyridine?
The IUPAC name of 2-(1-benzyl-5-methylpyrrolidin-2-yl)pyridine (CID 51039568) is 2-(1-benzyl-5-methylpyrrolidin-2-yl)pyridine.
What is the SMILES notation for 2-(1-benzyl-5-methylpyrrolidin-2-yl)pyridine?
The canonical SMILES for 2-(1-benzyl-5-methylpyrrolidin-2-yl)pyridine is CC1CCC(c2ccccn2)N1Cc1ccccc1.
What is the InChIKey of 2-(1-benzyl-5-methylpyrrolidin-2-yl)pyridine?
The InChIKey is VDQSUFJUNNMQGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2/c1-14-10-11-17(16-9-5-6-12-18-16)19(14)13-15-7-3-2-4-8-15/h2-9,12,14,17H,10-11,13H2,1H3.
What are the key properties of 2-(1-benzyl-5-methylpyrrolidin-2-yl)pyridine?
2-(1-benzyl-5-methylpyrrolidin-2-yl)pyridine has a molecular weight of 252.36 g/mol, XLogP of 3.81, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-benzyl-5-methylpyrrolidin-2-yl)pyridine is sourced from PubChem (CID 51039568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).