2-(2-fluorophenyl)-4-phenylpiperidine-1-carbaldehyde

C18H18FNO — CID 140572402

IUPAC2-(2-fluorophenyl)-4-phenylpiperidine-1-carbaldehyde
SMILESO=CN1CCC(c2ccccc2)CC1c1ccccc1F
InChIInChI=1S/C18H18FNO/c19-17-9-5-4-8-16(17)18-12-15(10-11-20(18)13-21)14-6-2-1-3-7-14/h1-9,13,15,18H,10-12H2
InChIKeyQUSKUTYJLPMSGU-UHFFFAOYSA-N
MW283.35 g/mol
LogP3.90
Rot. Bonds3

About 2-(2-fluorophenyl)-4-phenylpiperidine-1-carbaldehyde

2-(2-fluorophenyl)-4-phenylpiperidine-1-carbaldehyde (PubChem CID 140572402) has the molecular formula C18H18FNO and a molecular weight of 283.35 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-4-phenylpiperidine-1-carbaldehyde.

Molecular Properties

Compound Name2-(2-fluorophenyl)-4-phenylpiperidine-1-carbaldehyde
PubChem CID140572402
Molecular FormulaC18H18FNO
Molecular Weight283.35 g/mol
Exact Mass283.14
IUPAC Name2-(2-fluorophenyl)-4-phenylpiperidine-1-carbaldehyde
SMILESO=CN1CCC(c2ccccc2)CC1c1ccccc1F
InChIInChI=1S/C18H18FNO/c19-17-9-5-4-8-16(17)18-12-15(10-11-20(18)13-21)14-6-2-1-3-7-14/h1-9,13,15,18H,10-12H2
InChIKeyQUSKUTYJLPMSGU-UHFFFAOYSA-N
XLogP3.90
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.35
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-phenylazetidine-1-carbaldehyde
CID 172843566
4-(2-fluorophenyl)piperidine-1-carbaldehyde
CID 87956080
4-phenyl-2-propan-2-ylpiperidine-1-carbaldehyde
CID 76543536
4-amino-2-phenylpiperidine-1-carbaldehyde
CID 165142016
(3S)-3-phenylpyrrolidine-1-carbaldehyde
CID 175059746
4-phenyl-2-propylazepane-1-carbaldehyde
CID 87562749
bis[4-(2-fluorophenyl)piperidin-1-yl]methanone
CID 174617068
1-fluoro-4-phenylpiperidine
CID 143940552
2-[3-(2-fluorophenyl)pyrrolidin-1-yl]-1-phenylethanone
CID 140930148
1-(2-bicyclo[2.2.1]heptanyl)-4-(2-fluorophenyl)piperidine
CID 58772016
(2R)-1-(benzenesulfonyl)-2-(2-fluorophenyl)pyrrolidine
CID 51856093
2-(2,5-difluorophenyl)azepane-1-carbaldehyde
CID 176681918

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-4-phenylpiperidine-1-carbaldehyde?
The IUPAC name of 2-(2-fluorophenyl)-4-phenylpiperidine-1-carbaldehyde (CID 140572402) is 2-(2-fluorophenyl)-4-phenylpiperidine-1-carbaldehyde.
What is the SMILES notation for 2-(2-fluorophenyl)-4-phenylpiperidine-1-carbaldehyde?
The canonical SMILES for 2-(2-fluorophenyl)-4-phenylpiperidine-1-carbaldehyde is O=CN1CCC(c2ccccc2)CC1c1ccccc1F.
What is the InChIKey of 2-(2-fluorophenyl)-4-phenylpiperidine-1-carbaldehyde?
The InChIKey is QUSKUTYJLPMSGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18FNO/c19-17-9-5-4-8-16(17)18-12-15(10-11-20(18)13-21)14-6-2-1-3-7-14/h1-9,13,15,18H,10-12H2.
What are the key properties of 2-(2-fluorophenyl)-4-phenylpiperidine-1-carbaldehyde?
2-(2-fluorophenyl)-4-phenylpiperidine-1-carbaldehyde has a molecular weight of 283.35 g/mol, XLogP of 3.90, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-4-phenylpiperidine-1-carbaldehyde is sourced from PubChem (CID 140572402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).