(4-fluorophenyl)-[3-(4-fluorophenyl)piperidin-1-yl]methanone

C18H17F2NO — CID 70334763

IUPAC(4-fluorophenyl)-[3-(4-fluorophenyl)piperidin-1-yl]methanone
SMILESO=C(c1ccc(F)cc1)N1CCCC(c2ccc(F)cc2)C1
InChIInChI=1S/C18H17F2NO/c19-16-7-3-13(4-8-16)15-2-1-11-21(12-15)18(22)14-5-9-17(20)10-6-14/h3-10,15H,1-2,11-12H2
InChIKeyRFNMKRYZCIIMCZ-UHFFFAOYSA-N
MW301.34 g/mol
LogP3.98
Rot. Bonds2

About (4-fluorophenyl)-[3-(4-fluorophenyl)piperidin-1-yl]methanone

(4-fluorophenyl)-[3-(4-fluorophenyl)piperidin-1-yl]methanone (PubChem CID 70334763) has the molecular formula C18H17F2NO and a molecular weight of 301.34 g/mol. Its IUPAC name is (4-fluorophenyl)-[3-(4-fluorophenyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(4-fluorophenyl)-[3-(4-fluorophenyl)piperidin-1-yl]methanone
PubChem CID70334763
Molecular FormulaC18H17F2NO
Molecular Weight301.34 g/mol
Exact Mass301.13
IUPAC Name(4-fluorophenyl)-[3-(4-fluorophenyl)piperidin-1-yl]methanone
SMILESO=C(c1ccc(F)cc1)N1CCCC(c2ccc(F)cc2)C1
InChIInChI=1S/C18H17F2NO/c19-16-7-3-13(4-8-16)15-2-1-11-21(12-15)18(22)14-5-9-17(20)10-6-14/h3-10,15H,1-2,11-12H2
InChIKeyRFNMKRYZCIIMCZ-UHFFFAOYSA-N
XLogP3.98
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.34
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(4-bromophenyl)-[3-(4-fluorophenyl)azepan-1-yl]methanone
CID 72717452
(4-fluorophenyl)-(3-methylpiperidin-1-yl)methanone
CID 3113489
[(3R)-3-(4-fluorophenyl)azepan-1-yl]-(furan-3-yl)methanone
CID 99883345
[3,5-bis(trifluoromethyl)phenyl]-[3-(4-fluorophenyl)azepan-1-yl]methanone
CID 121130936
[(3R)-1-(4-fluorobenzoyl)piperidin-3-yl]-piperidin-1-ylmethanone
CID 936701
4-[3-(4-fluorophenyl)azepane-1-carbonyl]-6-hydroxy-1H-pyridin-2-one
CID 121146340
[3-(4-fluorophenyl)azepan-1-yl]-(3-methylphenyl)methanone
CID 90608748
[3-(4-fluorophenyl)azepan-1-yl]-[6-(trifluoromethyl)-3-pyridinyl]methanone
CID 121146311
(4-fluorophenyl)-[3-(methylamino)piperidin-1-yl]methanone
CID 62535610
(3S)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 68704612
[1-(4-fluorobenzoyl)piperidin-3-yl]-(4-phenylpiperidin-1-yl)methanone
CID 134799195
3H-benzimidazol-5-yl-[(3R)-3-(4-fluorophenyl)azepan-1-yl]methanone
CID 99873270

Frequently Asked Questions

What is the IUPAC name of (4-fluorophenyl)-[3-(4-fluorophenyl)piperidin-1-yl]methanone?
The IUPAC name of (4-fluorophenyl)-[3-(4-fluorophenyl)piperidin-1-yl]methanone (CID 70334763) is (4-fluorophenyl)-[3-(4-fluorophenyl)piperidin-1-yl]methanone.
What is the SMILES notation for (4-fluorophenyl)-[3-(4-fluorophenyl)piperidin-1-yl]methanone?
The canonical SMILES for (4-fluorophenyl)-[3-(4-fluorophenyl)piperidin-1-yl]methanone is O=C(c1ccc(F)cc1)N1CCCC(c2ccc(F)cc2)C1.
What is the InChIKey of (4-fluorophenyl)-[3-(4-fluorophenyl)piperidin-1-yl]methanone?
The InChIKey is RFNMKRYZCIIMCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17F2NO/c19-16-7-3-13(4-8-16)15-2-1-11-21(12-15)18(22)14-5-9-17(20)10-6-14/h3-10,15H,1-2,11-12H2.
What are the key properties of (4-fluorophenyl)-[3-(4-fluorophenyl)piperidin-1-yl]methanone?
(4-fluorophenyl)-[3-(4-fluorophenyl)piperidin-1-yl]methanone has a molecular weight of 301.34 g/mol, XLogP of 3.98, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluorophenyl)-[3-(4-fluorophenyl)piperidin-1-yl]methanone is sourced from PubChem (CID 70334763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).