1-(3-fluorobenzoyl)-N-phenylpiperidine-4-carboxamide

C19H19FN2O2 — CID 17223576

IUPAC1-(3-fluorobenzoyl)-N-phenylpiperidine-4-carboxamide
SMILESO=C(Nc1ccccc1)C1CCN(C(=O)c2cccc(F)c2)CC1
InChIInChI=1S/C19H19FN2O2/c20-16-6-4-5-15(13-16)19(24)22-11-9-14(10-12-22)18(23)21-17-7-2-1-3-8-17/h1-8,13-14H,9-12H2,(H,21,23)
InChIKeyJTFXMSLOCKOOBU-UHFFFAOYSA-N
MW326.37 g/mol
LogP3.32
Rot. Bonds3

About 1-(3-fluorobenzoyl)-N-phenylpiperidine-4-carboxamide

1-(3-fluorobenzoyl)-N-phenylpiperidine-4-carboxamide (PubChem CID 17223576) has the molecular formula C19H19FN2O2 and a molecular weight of 326.37 g/mol. Its IUPAC name is 1-(3-fluorobenzoyl)-N-phenylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(3-fluorobenzoyl)-N-phenylpiperidine-4-carboxamide
PubChem CID17223576
Molecular FormulaC19H19FN2O2
Molecular Weight326.37 g/mol
Exact Mass326.14
IUPAC Name1-(3-fluorobenzoyl)-N-phenylpiperidine-4-carboxamide
SMILESO=C(Nc1ccccc1)C1CCN(C(=O)c2cccc(F)c2)CC1
InChIInChI=1S/C19H19FN2O2/c20-16-6-4-5-15(13-16)19(24)22-11-9-14(10-12-22)18(23)21-17-7-2-1-3-8-17/h1-8,13-14H,9-12H2,(H,21,23)
InChIKeyJTFXMSLOCKOOBU-UHFFFAOYSA-N
XLogP3.32
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.37
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-benzoyl-N-(3-fluorophenyl)piperidine-4-carboxamide
CID 110298375
1-(3-fluorobenzoyl)-N-pyridin-3-ylpiperidine-4-carboxamide
CID 17223654
N-(3-fluorophenyl)-1-(3-methylbenzoyl)piperidine-4-carboxamide
CID 113008221
1-(3-fluorobenzoyl)-N-(4-sulfamoylphenyl)piperidine-4-carboxamide
CID 17223695
N-[4-(diethylamino)phenyl]-1-(3-fluorobenzoyl)piperidine-4-carboxamide
CID 113008104
3-[(1-benzoylpiperidine-4-carbonyl)amino]benzoic acid
CID 119219598
N-(3-chloro-4-methylphenyl)-1-(3-fluorobenzoyl)piperidine-4-carboxamide
CID 17223687
1-(3,4-dichlorobenzoyl)-N-(3-fluorophenyl)piperidine-4-carboxamide
CID 113008225
1-[3-(dimethylamino)benzoyl]-N-phenylpiperidine-4-carboxamide
CID 41263290
N-(2-cyanophenyl)-1-(3-fluorobenzoyl)piperidine-4-carboxamide
CID 17223693
1-(2,5-difluorobenzoyl)-N-phenylpiperidine-4-carboxamide
CID 46808218
propyl 4-[[1-(3-fluorobenzoyl)piperidine-4-carbonyl]amino]benzoate
CID 17223615

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorobenzoyl)-N-phenylpiperidine-4-carboxamide?
The IUPAC name of 1-(3-fluorobenzoyl)-N-phenylpiperidine-4-carboxamide (CID 17223576) is 1-(3-fluorobenzoyl)-N-phenylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(3-fluorobenzoyl)-N-phenylpiperidine-4-carboxamide?
The canonical SMILES for 1-(3-fluorobenzoyl)-N-phenylpiperidine-4-carboxamide is O=C(Nc1ccccc1)C1CCN(C(=O)c2cccc(F)c2)CC1.
What is the InChIKey of 1-(3-fluorobenzoyl)-N-phenylpiperidine-4-carboxamide?
The InChIKey is JTFXMSLOCKOOBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN2O2/c20-16-6-4-5-15(13-16)19(24)22-11-9-14(10-12-22)18(23)21-17-7-2-1-3-8-17/h1-8,13-14H,9-12H2,(H,21,23).
What are the key properties of 1-(3-fluorobenzoyl)-N-phenylpiperidine-4-carboxamide?
1-(3-fluorobenzoyl)-N-phenylpiperidine-4-carboxamide has a molecular weight of 326.37 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorobenzoyl)-N-phenylpiperidine-4-carboxamide is sourced from PubChem (CID 17223576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).