2-[(3-fluorophenyl)methyl]-6-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyridine

C23H24FN3 — CID 95809203

IUPAC2-[(3-fluorophenyl)methyl]-6-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyridine
SMILESFc1cccc(Cc2cccc([C@@H]3CCCN(Cc4cccnc4)C3)n2)c1
InChIInChI=1S/C23H24FN3/c24-21-8-1-5-18(13-21)14-22-9-2-10-23(26-22)20-7-4-12-27(17-20)16-19-6-3-11-25-15-19/h1-3,5-6,8-11,13,15,20H,4,7,12,14,16-17H2/t20-/m1/s1
InChIKeyKFGVDMXOURLCTK-HXUWFJFHSA-N
MW361.46 g/mol
LogP4.59
Rot. Bonds5

About 2-[(3-fluorophenyl)methyl]-6-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyridine

2-[(3-fluorophenyl)methyl]-6-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyridine (PubChem CID 95809203) has the molecular formula C23H24FN3 and a molecular weight of 361.46 g/mol. Its IUPAC name is 2-[(3-fluorophenyl)methyl]-6-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyridine.

Molecular Properties

Compound Name2-[(3-fluorophenyl)methyl]-6-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyridine
PubChem CID95809203
Molecular FormulaC23H24FN3
Molecular Weight361.46 g/mol
Exact Mass361.20
IUPAC Name2-[(3-fluorophenyl)methyl]-6-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyridine
SMILESFc1cccc(Cc2cccc([C@@H]3CCCN(Cc4cccnc4)C3)n2)c1
InChIInChI=1S/C23H24FN3/c24-21-8-1-5-18(13-21)14-22-9-2-10-23(26-22)20-7-4-12-27(17-20)16-19-6-3-11-25-15-19/h1-3,5-6,8-11,13,15,20H,4,7,12,14,16-17H2/t20-/m1/s1
InChIKeyKFGVDMXOURLCTK-HXUWFJFHSA-N
XLogP4.59
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.46
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3-fluorophenyl)methyl]-6-[1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine
CID 110249363
2-[(3-methoxyphenyl)methyl]-6-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyridine
CID 95809205
2-[(3-methoxyphenyl)methyl]-6-[(3R)-1-(pyridin-4-ylmethyl)piperidin-3-yl]pyridine
CID 95809167
2-[3-[6-[(3-fluorophenyl)methyl]-2-pyridinyl]piperidin-1-yl]-1-piperidin-1-ylethanone
CID 110249321
2-benzyl-6-[1-(pyridin-3-ylmethyl)piperidin-4-yl]pyridine
CID 95809192
5-(3-fluorophenyl)-4-[1-(pyridin-3-ylmethyl)piperidin-3-yl]pyrimidin-2-amine
CID 110248800
2-[3-[6-[(3-fluorophenyl)methyl]-2-pyridinyl]piperidin-1-yl]-N-pyridin-2-ylacetamide
CID 110249660
2-methyl-4-[1-(pyridin-3-ylmethyl)piperidin-3-yl]pyrimidine
CID 110091435
(3R)-3-[6-[(3-fluorophenyl)methyl]-2-pyridinyl]-N,N-dimethylpiperidine-1-sulfonamide
CID 95809657
2-[(3-methylphenyl)methyl]-6-[(3S)-1-(pyridin-2-ylmethyl)piperidin-3-yl]pyridine
CID 95809284
2-(4-fluorophenyl)-1-[3-[6-[(3-fluorophenyl)methyl]-2-pyridinyl]piperidin-1-yl]ethanone
CID 110249685
6-[(3S)-1-[(3-fluorophenyl)methyl]piperidin-3-yl]-N,N-dimethyl-2-pyridin-3-ylpyrimidin-4-amine
CID 92606935

Frequently Asked Questions

What is the IUPAC name of 2-[(3-fluorophenyl)methyl]-6-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyridine?
The IUPAC name of 2-[(3-fluorophenyl)methyl]-6-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyridine (CID 95809203) is 2-[(3-fluorophenyl)methyl]-6-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyridine.
What is the SMILES notation for 2-[(3-fluorophenyl)methyl]-6-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyridine?
The canonical SMILES for 2-[(3-fluorophenyl)methyl]-6-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyridine is Fc1cccc(Cc2cccc([C@@H]3CCCN(Cc4cccnc4)C3)n2)c1.
What is the InChIKey of 2-[(3-fluorophenyl)methyl]-6-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyridine?
The InChIKey is KFGVDMXOURLCTK-HXUWFJFHSA-N. The full InChI is InChI=1S/C23H24FN3/c24-21-8-1-5-18(13-21)14-22-9-2-10-23(26-22)20-7-4-12-27(17-20)16-19-6-3-11-25-15-19/h1-3,5-6,8-11,13,15,20H,4,7,12,14,16-17H2/t20-/m1/s1.
What are the key properties of 2-[(3-fluorophenyl)methyl]-6-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyridine?
2-[(3-fluorophenyl)methyl]-6-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyridine has a molecular weight of 361.46 g/mol, XLogP of 4.59, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-fluorophenyl)methyl]-6-[(3R)-1-(pyridin-3-ylmethyl)piperidin-3-yl]pyridine is sourced from PubChem (CID 95809203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).