1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide

C13H16FN3O2 — CID 108893994

IUPAC1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide
SMILESNC(=O)C1CCN(C(=O)Nc2cccc(F)c2)CC1
InChIInChI=1S/C13H16FN3O2/c14-10-2-1-3-11(8-10)16-13(19)17-6-4-9(5-7-17)12(15)18/h1-3,8-9H,4-7H2,(H2,15,18)(H,16,19)
InChIKeyFPUNHTJYSDBFBD-UHFFFAOYSA-N
MW265.29 g/mol
LogP1.55
Rot. Bonds2

About 1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide

1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide (PubChem CID 108893994) has the molecular formula C13H16FN3O2 and a molecular weight of 265.29 g/mol. Its IUPAC name is 1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide
PubChem CID108893994
Molecular FormulaC13H16FN3O2
Molecular Weight265.29 g/mol
Exact Mass265.12
IUPAC Name1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide
SMILESNC(=O)C1CCN(C(=O)Nc2cccc(F)c2)CC1
InChIInChI=1S/C13H16FN3O2/c14-10-2-1-3-11(8-10)16-13(19)17-6-4-9(5-7-17)12(15)18/h1-3,8-9H,4-7H2,(H2,15,18)(H,16,19)
InChIKeyFPUNHTJYSDBFBD-UHFFFAOYSA-N
XLogP1.55
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.29
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-fluorophenyl)pyrrolidine-1-carboxamide
CID 6469622
1-N-(3-methylphenyl)piperidine-1,4-dicarboxamide
CID 16645831
1-N-[3-(1-hydroxyethyl)phenyl]piperidine-1,4-dicarboxamide
CID 61347794
4-(2-aminophenyl)-N-(3-fluorophenyl)piperidine-1-carboxamide
CID 170456870
(3S)-N-(3-fluorophenyl)-3-(methylamino)pyrrolidine-1-carboxamide
CID 172646365
1-N-[(3-fluorophenyl)methyl]piperidine-1,4-dicarboxamide
CID 47027642
4-benzyl-N-(3-fluorophenyl)piperidine-1-carboxamide
CID 3570835
N-(3-fluorophenyl)-4-sulfamoylpiperazine-1-carboxamide
CID 61131305
3-amino-N-(3-fluorophenyl)azetidine-1-carboxamide;hydrochloride
CID 139034966
4-N-(3-fluorophenyl)-1-N-propan-2-ylpiperidine-1,4-dicarboxamide
CID 113008251
(3S,6S)-1-N-(3-fluorophenyl)-6-methylpiperidine-1,3-dicarboxamide
CID 97221670
1-(cyclopropanecarbonyl)-N-(3-fluorophenyl)piperidine-4-carboxamide
CID 26086523

Frequently Asked Questions

What is the IUPAC name of 1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide?
The IUPAC name of 1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide (CID 108893994) is 1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide.
What is the SMILES notation for 1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide?
The canonical SMILES for 1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide is NC(=O)C1CCN(C(=O)Nc2cccc(F)c2)CC1.
What is the InChIKey of 1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide?
The InChIKey is FPUNHTJYSDBFBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16FN3O2/c14-10-2-1-3-11(8-10)16-13(19)17-6-4-9(5-7-17)12(15)18/h1-3,8-9H,4-7H2,(H2,15,18)(H,16,19).
What are the key properties of 1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide?
1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide has a molecular weight of 265.29 g/mol, XLogP of 1.55, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide is sourced from PubChem (CID 108893994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).