1-(2-fluorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide

C21H25FN2O — CID 17152720

IUPAC1-(2-fluorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide
SMILESCC(C)c1ccc(NC(=O)C2CCN(c3ccccc3F)CC2)cc1
InChIInChI=1S/C21H25FN2O/c1-15(2)16-7-9-18(10-8-16)23-21(25)17-11-13-24(14-12-17)20-6-4-3-5-19(20)22/h3-10,15,17H,11-14H2,1-2H3,(H,23,25)
InChIKeyLWDYZVSRNGOPFG-UHFFFAOYSA-N
MW340.44 g/mol
LogP4.80
Rot. Bonds4

About 1-(2-fluorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide

1-(2-fluorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide (PubChem CID 17152720) has the molecular formula C21H25FN2O and a molecular weight of 340.44 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-fluorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide
PubChem CID17152720
Molecular FormulaC21H25FN2O
Molecular Weight340.44 g/mol
Exact Mass340.20
IUPAC Name1-(2-fluorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide
SMILESCC(C)c1ccc(NC(=O)C2CCN(c3ccccc3F)CC2)cc1
InChIInChI=1S/C21H25FN2O/c1-15(2)16-7-9-18(10-8-16)23-21(25)17-11-13-24(14-12-17)20-6-4-3-5-19(20)22/h3-10,15,17H,11-14H2,1-2H3,(H,23,25)
InChIKeyLWDYZVSRNGOPFG-UHFFFAOYSA-N
XLogP4.80
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.44
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-fluorophenyl)-N-(4-fluorophenyl)piperidine-4-carboxamide
CID 17152616
N-(3,4-dimethylphenyl)-1-(2-fluorophenyl)piperidine-4-carboxamide
CID 17152605
N,1-bis(2-fluorophenyl)piperidine-4-carboxamide
CID 17152573
ethane;N-(4-propan-2-ylphenyl)cyclopropanecarboxamide
CID 143709659
N-(4,6-dimethylpyrimidin-2-yl)-1-(2-fluorophenyl)piperidine-4-carboxamide
CID 17152729
1-(3-chlorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide
CID 17153034
N-(2-butan-2-ylphenyl)-1-(2-fluorophenyl)piperidine-4-carboxamide
CID 17152752
N-(2-ethylphenyl)-1-(2-fluorophenyl)piperidine-4-carboxamide
CID 17152635
1-(2-fluorophenyl)-N-pentan-3-ylpiperidine-4-carboxamide
CID 17152735
1-(2-fluorophenyl)-N-(2-methoxyphenyl)piperidine-4-carboxamide
CID 17152653
1-(1,3-benzothiazol-2-yl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide
CID 90609326
1-(2-fluorophenyl)-N-[4-(hexylsulfamoyl)phenyl]piperidine-4-carboxamide
CID 17152786

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide?
The IUPAC name of 1-(2-fluorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide (CID 17152720) is 1-(2-fluorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-fluorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide?
The canonical SMILES for 1-(2-fluorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide is CC(C)c1ccc(NC(=O)C2CCN(c3ccccc3F)CC2)cc1.
What is the InChIKey of 1-(2-fluorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide?
The InChIKey is LWDYZVSRNGOPFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25FN2O/c1-15(2)16-7-9-18(10-8-16)23-21(25)17-11-13-24(14-12-17)20-6-4-3-5-19(20)22/h3-10,15,17H,11-14H2,1-2H3,(H,23,25).
What are the key properties of 1-(2-fluorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide?
1-(2-fluorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide has a molecular weight of 340.44 g/mol, XLogP of 4.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-N-(4-propan-2-ylphenyl)piperidine-4-carboxamide is sourced from PubChem (CID 17152720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).