N-(4-fluorophenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide

C23H23FN2O — CID 43921446

IUPACN-(4-fluorophenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1CCCN(Cc2cccc3ccccc23)C1
InChIInChI=1S/C23H23FN2O/c24-20-10-12-21(13-11-20)25-23(27)19-8-4-14-26(16-19)15-18-7-3-6-17-5-1-2-9-22(17)18/h1-3,5-7,9-13,19H,4,8,14-16H2,(H,25,27)
InChIKeyVDTZIJWRNXLWGR-UHFFFAOYSA-N
MW362.45 g/mol
LogP4.83
Rot. Bonds4

About N-(4-fluorophenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide

N-(4-fluorophenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide (PubChem CID 43921446) has the molecular formula C23H23FN2O and a molecular weight of 362.45 g/mol. Its IUPAC name is N-(4-fluorophenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide
PubChem CID43921446
Molecular FormulaC23H23FN2O
Molecular Weight362.45 g/mol
Exact Mass362.18
IUPAC NameN-(4-fluorophenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1)C1CCCN(Cc2cccc3ccccc23)C1
InChIInChI=1S/C23H23FN2O/c24-20-10-12-21(13-11-20)25-23(27)19-8-4-14-26(16-19)15-18-7-3-6-17-5-1-2-9-22(17)18/h1-3,5-7,9-13,19H,4,8,14-16H2,(H,25,27)
InChIKeyVDTZIJWRNXLWGR-UHFFFAOYSA-N
XLogP4.83
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.45
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-naphthalen-2-yl-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide
CID 43919649
N-(3-chloro-4-methylphenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide
CID 43921707
N-(3-acetylphenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide
CID 43924471
1-[(2-fluorophenyl)methyl]-N-naphthalen-1-ylpiperidine-3-carboxamide
CID 43919580
N-(2-ethoxyphenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide
CID 43919757
(3R)-N-(4-chlorophenyl)-1-[(4-fluorophenyl)methyl]piperidine-3-carboxamide
CID 93490550
(3R)-1-[(2-chlorophenyl)methyl]-N-naphthalen-1-ylpiperidine-3-carboxamide
CID 93490606
1-(naphthalen-1-ylmethyl)-N-phenylpiperidine-4-carboxamide
CID 18089122
N-[(2-methoxyphenyl)methyl]-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide
CID 43921128
1-[(2-chlorophenyl)methyl]-N-(4-methoxyphenyl)piperidine-3-carboxamide
CID 43919687
N-(4-iodophenyl)-1-(naphthalen-1-ylmethyl)piperidine-4-carboxamide
CID 43920099
1-[(2-fluorophenyl)methyl]-N-(3-methoxyphenyl)piperidine-3-carboxamide
CID 43919659

Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide?
The IUPAC name of N-(4-fluorophenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide (CID 43921446) is N-(4-fluorophenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide.
What is the SMILES notation for N-(4-fluorophenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide?
The canonical SMILES for N-(4-fluorophenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide is O=C(Nc1ccc(F)cc1)C1CCCN(Cc2cccc3ccccc23)C1.
What is the InChIKey of N-(4-fluorophenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide?
The InChIKey is VDTZIJWRNXLWGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23FN2O/c24-20-10-12-21(13-11-20)25-23(27)19-8-4-14-26(16-19)15-18-7-3-6-17-5-1-2-9-22(17)18/h1-3,5-7,9-13,19H,4,8,14-16H2,(H,25,27).
What are the key properties of N-(4-fluorophenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide?
N-(4-fluorophenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide has a molecular weight of 362.45 g/mol, XLogP of 4.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-1-(naphthalen-1-ylmethyl)piperidine-3-carboxamide is sourced from PubChem (CID 43921446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).