[4-(4-fluoro-3-methylphenyl)phenyl]-(4-hydroxypiperidin-1-yl)methanone

C19H20FNO2 — CID 70288816

IUPAC[4-(4-fluoro-3-methylphenyl)phenyl]-(4-hydroxypiperidin-1-yl)methanone
SMILESCc1cc(-c2ccc(C(=O)N3CCC(O)CC3)cc2)ccc1F
InChIInChI=1S/C19H20FNO2/c1-13-12-16(6-7-18(13)20)14-2-4-15(5-3-14)19(23)21-10-8-17(22)9-11-21/h2-7,12,17,22H,8-11H2,1H3
InChIKeyXLQCQCJHJDSMFD-UHFFFAOYSA-N
MW313.37 g/mol
LogP3.40
Rot. Bonds2

About [4-(4-fluoro-3-methylphenyl)phenyl]-(4-hydroxypiperidin-1-yl)methanone

[4-(4-fluoro-3-methylphenyl)phenyl]-(4-hydroxypiperidin-1-yl)methanone (PubChem CID 70288816) has the molecular formula C19H20FNO2 and a molecular weight of 313.37 g/mol. Its IUPAC name is [4-(4-fluoro-3-methylphenyl)phenyl]-(4-hydroxypiperidin-1-yl)methanone.

Molecular Properties

Compound Name[4-(4-fluoro-3-methylphenyl)phenyl]-(4-hydroxypiperidin-1-yl)methanone
PubChem CID70288816
Molecular FormulaC19H20FNO2
Molecular Weight313.37 g/mol
Exact Mass313.15
IUPAC Name[4-(4-fluoro-3-methylphenyl)phenyl]-(4-hydroxypiperidin-1-yl)methanone
SMILESCc1cc(-c2ccc(C(=O)N3CCC(O)CC3)cc2)ccc1F
InChIInChI=1S/C19H20FNO2/c1-13-12-16(6-7-18(13)20)14-2-4-15(5-3-14)19(23)21-10-8-17(22)9-11-21/h2-7,12,17,22H,8-11H2,1H3
InChIKeyXLQCQCJHJDSMFD-UHFFFAOYSA-N
XLogP3.40
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.37
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-(4-fluoro-3-methylphenyl)phenyl]-(4-hydroxypiperidin-1-yl)methanone?
The IUPAC name of [4-(4-fluoro-3-methylphenyl)phenyl]-(4-hydroxypiperidin-1-yl)methanone (CID 70288816) is [4-(4-fluoro-3-methylphenyl)phenyl]-(4-hydroxypiperidin-1-yl)methanone.
What is the SMILES notation for [4-(4-fluoro-3-methylphenyl)phenyl]-(4-hydroxypiperidin-1-yl)methanone?
The canonical SMILES for [4-(4-fluoro-3-methylphenyl)phenyl]-(4-hydroxypiperidin-1-yl)methanone is Cc1cc(-c2ccc(C(=O)N3CCC(O)CC3)cc2)ccc1F.
What is the InChIKey of [4-(4-fluoro-3-methylphenyl)phenyl]-(4-hydroxypiperidin-1-yl)methanone?
The InChIKey is XLQCQCJHJDSMFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FNO2/c1-13-12-16(6-7-18(13)20)14-2-4-15(5-3-14)19(23)21-10-8-17(22)9-11-21/h2-7,12,17,22H,8-11H2,1H3.
What are the key properties of [4-(4-fluoro-3-methylphenyl)phenyl]-(4-hydroxypiperidin-1-yl)methanone?
[4-(4-fluoro-3-methylphenyl)phenyl]-(4-hydroxypiperidin-1-yl)methanone has a molecular weight of 313.37 g/mol, XLogP of 3.40, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(4-fluoro-3-methylphenyl)phenyl]-(4-hydroxypiperidin-1-yl)methanone is sourced from PubChem (CID 70288816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).