4-[(4-fluorophenyl)methyl]-2-methyl-6-piperidin-3-ylpyridine

C18H21FN2 — CID 110252938

IUPAC4-[(4-fluorophenyl)methyl]-2-methyl-6-piperidin-3-ylpyridine
SMILESCc1cc(Cc2ccc(F)cc2)cc(C2CCCNC2)n1
InChIInChI=1S/C18H21FN2/c1-13-9-15(10-14-4-6-17(19)7-5-14)11-18(21-13)16-3-2-8-20-12-16/h4-7,9,11,16,20H,2-3,8,10,12H2,1H3
InChIKeyJPDZGSPFHKYVSM-UHFFFAOYSA-N
MW284.38 g/mol
LogP3.59
Rot. Bonds3

About 4-[(4-fluorophenyl)methyl]-2-methyl-6-piperidin-3-ylpyridine

4-[(4-fluorophenyl)methyl]-2-methyl-6-piperidin-3-ylpyridine (PubChem CID 110252938) has the molecular formula C18H21FN2 and a molecular weight of 284.38 g/mol. Its IUPAC name is 4-[(4-fluorophenyl)methyl]-2-methyl-6-piperidin-3-ylpyridine.

Molecular Properties

Compound Name4-[(4-fluorophenyl)methyl]-2-methyl-6-piperidin-3-ylpyridine
PubChem CID110252938
Molecular FormulaC18H21FN2
Molecular Weight284.38 g/mol
Exact Mass284.17
IUPAC Name4-[(4-fluorophenyl)methyl]-2-methyl-6-piperidin-3-ylpyridine
SMILESCc1cc(Cc2ccc(F)cc2)cc(C2CCCNC2)n1
InChIInChI=1S/C18H21FN2/c1-13-9-15(10-14-4-6-17(19)7-5-14)11-18(21-13)16-3-2-8-20-12-16/h4-7,9,11,16,20H,2-3,8,10,12H2,1H3
InChIKeyJPDZGSPFHKYVSM-UHFFFAOYSA-N
XLogP3.59
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

CID 71219
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CID 500899
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CID 161283
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CID 9423
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CID 10425802
CID 10425802
CID 3087102
CID 3087102
CID 24764596
CID 24764596
CID 24798098
CID 24798098
CID 44414862
CID 44414862
CID 45259040
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CID 45259041
CID 45259041
CID 130449136
CID 130449136

Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluorophenyl)methyl]-2-methyl-6-piperidin-3-ylpyridine?
The IUPAC name of 4-[(4-fluorophenyl)methyl]-2-methyl-6-piperidin-3-ylpyridine (CID 110252938) is 4-[(4-fluorophenyl)methyl]-2-methyl-6-piperidin-3-ylpyridine.
What is the SMILES notation for 4-[(4-fluorophenyl)methyl]-2-methyl-6-piperidin-3-ylpyridine?
The canonical SMILES for 4-[(4-fluorophenyl)methyl]-2-methyl-6-piperidin-3-ylpyridine is Cc1cc(Cc2ccc(F)cc2)cc(C2CCCNC2)n1.
What is the InChIKey of 4-[(4-fluorophenyl)methyl]-2-methyl-6-piperidin-3-ylpyridine?
The InChIKey is JPDZGSPFHKYVSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21FN2/c1-13-9-15(10-14-4-6-17(19)7-5-14)11-18(21-13)16-3-2-8-20-12-16/h4-7,9,11,16,20H,2-3,8,10,12H2,1H3.
What are the key properties of 4-[(4-fluorophenyl)methyl]-2-methyl-6-piperidin-3-ylpyridine?
4-[(4-fluorophenyl)methyl]-2-methyl-6-piperidin-3-ylpyridine has a molecular weight of 284.38 g/mol, XLogP of 3.59, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-fluorophenyl)methyl]-2-methyl-6-piperidin-3-ylpyridine is sourced from PubChem (CID 110252938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).