2-[(2-methylphenyl)methyl]-5-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine

C24H27N3 — CID 124960780

IUPAC2-[(2-methylphenyl)methyl]-5-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine
SMILESCc1ccccc1Cc1ccc([C@H]2CCCCN2Cc2ccccn2)cn1
InChIInChI=1S/C24H27N3/c1-19-8-2-3-9-20(19)16-22-13-12-21(17-26-22)24-11-5-7-15-27(24)18-23-10-4-6-14-25-23/h2-4,6,8-10,12-14,17,24H,5,7,11,15-16,18H2,1H3/t24-/m1/s1
InChIKeyGWYBNKVLGHTKGR-XMMPIXPASA-N
MW357.50 g/mol
LogP5.10
Rot. Bonds5

About 2-[(2-methylphenyl)methyl]-5-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine

2-[(2-methylphenyl)methyl]-5-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine (PubChem CID 124960780) has the molecular formula C24H27N3 and a molecular weight of 357.50 g/mol. Its IUPAC name is 2-[(2-methylphenyl)methyl]-5-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine.

Molecular Properties

Compound Name2-[(2-methylphenyl)methyl]-5-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine
PubChem CID124960780
Molecular FormulaC24H27N3
Molecular Weight357.50 g/mol
Exact Mass357.22
IUPAC Name2-[(2-methylphenyl)methyl]-5-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine
SMILESCc1ccccc1Cc1ccc([C@H]2CCCCN2Cc2ccccn2)cn1
InChIInChI=1S/C24H27N3/c1-19-8-2-3-9-20(19)16-22-13-12-21(17-26-22)24-11-5-7-15-27(24)18-23-10-4-6-14-25-23/h2-4,6,8-10,12-14,17,24H,5,7,11,15-16,18H2,1H3/t24-/m1/s1
InChIKeyGWYBNKVLGHTKGR-XMMPIXPASA-N
XLogP5.10
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500357.50
LogP ≤ 55.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[(2-methylphenyl)methyl]-5-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cyclobutyl-[2-[6-[(2-methylphenyl)methyl]-3-pyridinyl]piperidin-1-yl]methanone
CID 127251981
2-methyl-4-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyrimidine
CID 95839903
1-[(2-methylphenyl)methyl]-2-pyridin-4-ylazepane
CID 112826237
2-[(2-chlorophenyl)methyl]-6-[(2S)-1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]pyridine
CID 95817957
N-methyl-4-[1-(pyridin-2-ylmethyl)piperidin-2-yl]pyrimidin-2-amine
CID 127244807
2-[(2-methylphenyl)methyl]-6-[1-(pyridin-2-ylmethyl)piperidin-4-yl]pyridine
CID 95809282
(3aS,6aS)-4-[(2-methylphenyl)methyl]-1-(pyridin-2-ylmethyl)-3,3a,6,6a-tetrahydro-2H-pyrrolo[3,2-b]pyrrol-5-one
CID 131682692
4-[(2S)-1-[[5-[(2-methylphenyl)methyl]-1,3,4-oxadiazol-2-yl]methyl]pyrrolidin-2-yl]phenol
CID 97226661
2-methyl-4-[[(2R)-2-pyridin-2-ylpiperidin-1-yl]methyl]-1,3-thiazole
CID 124755806
2-[[2-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]pyrrolidin-1-yl]methyl]pyridine;tetrahydrochloride
CID 138112738
[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]methanol
CID 94336697
2-(5-methylthiophen-2-yl)-5-[1-(pyridin-2-ylmethyl)pyrrolidin-2-yl]-1,3,4-oxadiazole
CID 110243137

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methylphenyl)methyl]-5-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine?
The IUPAC name of 2-[(2-methylphenyl)methyl]-5-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine (CID 124960780) is 2-[(2-methylphenyl)methyl]-5-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine.
What is the SMILES notation for 2-[(2-methylphenyl)methyl]-5-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine?
The canonical SMILES for 2-[(2-methylphenyl)methyl]-5-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine is Cc1ccccc1Cc1ccc([C@H]2CCCCN2Cc2ccccn2)cn1.
What is the InChIKey of 2-[(2-methylphenyl)methyl]-5-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine?
The InChIKey is GWYBNKVLGHTKGR-XMMPIXPASA-N. The full InChI is InChI=1S/C24H27N3/c1-19-8-2-3-9-20(19)16-22-13-12-21(17-26-22)24-11-5-7-15-27(24)18-23-10-4-6-14-25-23/h2-4,6,8-10,12-14,17,24H,5,7,11,15-16,18H2,1H3/t24-/m1/s1.
What are the key properties of 2-[(2-methylphenyl)methyl]-5-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine?
2-[(2-methylphenyl)methyl]-5-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine has a molecular weight of 357.50 g/mol, XLogP of 5.10, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylphenyl)methyl]-5-[(2R)-1-(pyridin-2-ylmethyl)piperidin-2-yl]pyridine is sourced from PubChem (CID 124960780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).