4-benzyl-N-(3-fluorophenyl)piperidine-1-carboxamide

C19H21FN2O — CID 3570835

IUPAC4-benzyl-N-(3-fluorophenyl)piperidine-1-carboxamide
SMILESO=C(Nc1cccc(F)c1)N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C19H21FN2O/c20-17-7-4-8-18(14-17)21-19(23)22-11-9-16(10-12-22)13-15-5-2-1-3-6-15/h1-8,14,16H,9-13H2,(H,21,23)
InChIKeyFZZGYRYHHAWJEF-UHFFFAOYSA-N
MW312.39 g/mol
LogP4.31
Rot. Bonds3

About 4-benzyl-N-(3-fluorophenyl)piperidine-1-carboxamide

4-benzyl-N-(3-fluorophenyl)piperidine-1-carboxamide (PubChem CID 3570835) has the molecular formula C19H21FN2O and a molecular weight of 312.39 g/mol. Its IUPAC name is 4-benzyl-N-(3-fluorophenyl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-benzyl-N-(3-fluorophenyl)piperidine-1-carboxamide
PubChem CID3570835
Molecular FormulaC19H21FN2O
Molecular Weight312.39 g/mol
Exact Mass312.16
IUPAC Name4-benzyl-N-(3-fluorophenyl)piperidine-1-carboxamide
SMILESO=C(Nc1cccc(F)c1)N1CCC(Cc2ccccc2)CC1
InChIInChI=1S/C19H21FN2O/c20-17-7-4-8-18(14-17)21-19(23)22-11-9-16(10-12-22)13-15-5-2-1-3-6-15/h1-8,14,16H,9-13H2,(H,21,23)
InChIKeyFZZGYRYHHAWJEF-UHFFFAOYSA-N
XLogP4.31
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.39
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-(4-benzylpiperidin-1-yl)-N-(3-fluorophenyl)azetidine-1-carboxamide
CID 67082537
4-benzyl-N-phenylpiperidine-1-carboxamide
CID 5064762
1-(4-benzylpiperidine-1-carbonyl)-N-(3-fluorophenyl)cyclopropane-1-carboxamide
CID 108980004
4-benzyl-N-(4-phenylphenyl)piperidine-1-carboxamide
CID 108867010
N-(3-fluorophenyl)-4-[(4-methylpiperidin-1-yl)methyl]piperidine-1-carboxamide
CID 46366148
N-(3-fluorophenyl)pyrrolidine-1-carboxamide
CID 6469622
1-N-(3-fluorophenyl)piperidine-1,4-dicarboxamide
CID 108893994
3-benzyl-N-(3-methylsulfinylphenyl)pyrrolidine-1-carboxamide
CID 71992201
4-[2-[(3-fluorobenzoyl)amino]ethyl]-N-(3-fluorophenyl)piperidine-1-carboxamide
CID 91903544
3-(4-benzylpiperidin-1-yl)-N-(4-fluorophenyl)azetidine-1-carboxamide
CID 23140030
4-[(3-fluorophenyl)methyl]-N-phenylpiperazine-1-carboxamide
CID 71456901
3-(4-benzylpiperidin-1-yl)-N-(3-methylsulfanylphenyl)azetidine-1-carboxamide
CID 23140490

Frequently Asked Questions

What is the IUPAC name of 4-benzyl-N-(3-fluorophenyl)piperidine-1-carboxamide?
The IUPAC name of 4-benzyl-N-(3-fluorophenyl)piperidine-1-carboxamide (CID 3570835) is 4-benzyl-N-(3-fluorophenyl)piperidine-1-carboxamide.
What is the SMILES notation for 4-benzyl-N-(3-fluorophenyl)piperidine-1-carboxamide?
The canonical SMILES for 4-benzyl-N-(3-fluorophenyl)piperidine-1-carboxamide is O=C(Nc1cccc(F)c1)N1CCC(Cc2ccccc2)CC1.
What is the InChIKey of 4-benzyl-N-(3-fluorophenyl)piperidine-1-carboxamide?
The InChIKey is FZZGYRYHHAWJEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O/c20-17-7-4-8-18(14-17)21-19(23)22-11-9-16(10-12-22)13-15-5-2-1-3-6-15/h1-8,14,16H,9-13H2,(H,21,23).
What are the key properties of 4-benzyl-N-(3-fluorophenyl)piperidine-1-carboxamide?
4-benzyl-N-(3-fluorophenyl)piperidine-1-carboxamide has a molecular weight of 312.39 g/mol, XLogP of 4.31, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-N-(3-fluorophenyl)piperidine-1-carboxamide is sourced from PubChem (CID 3570835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).