N-(2-fluorophenyl)-2-[2-(3-hydroxyphenyl)ethyl]piperidine-1-carboxamide

C20H23FN2O2 — CID 56882244

IUPACN-(2-fluorophenyl)-2-[2-(3-hydroxyphenyl)ethyl]piperidine-1-carboxamide
SMILESO=C(Nc1ccccc1F)N1CCCCC1CCc1cccc(O)c1
InChIInChI=1S/C20H23FN2O2/c21-18-9-1-2-10-19(18)22-20(25)23-13-4-3-7-16(23)12-11-15-6-5-8-17(24)14-15/h1-2,5-6,8-10,14,16,24H,3-4,7,11-13H2,(H,22,25)
InChIKeyNKEZDUXHPKGVMO-UHFFFAOYSA-N
MW342.41 g/mol
LogP4.55
Rot. Bonds4

About N-(2-fluorophenyl)-2-[2-(3-hydroxyphenyl)ethyl]piperidine-1-carboxamide

N-(2-fluorophenyl)-2-[2-(3-hydroxyphenyl)ethyl]piperidine-1-carboxamide (PubChem CID 56882244) has the molecular formula C20H23FN2O2 and a molecular weight of 342.41 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-[2-(3-hydroxyphenyl)ethyl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-2-[2-(3-hydroxyphenyl)ethyl]piperidine-1-carboxamide
PubChem CID56882244
Molecular FormulaC20H23FN2O2
Molecular Weight342.41 g/mol
Exact Mass342.17
IUPAC NameN-(2-fluorophenyl)-2-[2-(3-hydroxyphenyl)ethyl]piperidine-1-carboxamide
SMILESO=C(Nc1ccccc1F)N1CCCCC1CCc1cccc(O)c1
InChIInChI=1S/C20H23FN2O2/c21-18-9-1-2-10-19(18)22-20(25)23-13-4-3-7-16(23)12-11-15-6-5-8-17(24)14-15/h1-2,5-6,8-10,14,16,24H,3-4,7,11-13H2,(H,22,25)
InChIKeyNKEZDUXHPKGVMO-UHFFFAOYSA-N
XLogP4.55
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.41
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-fluorophenyl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]-2-oxoacetamide
CID 108520894
(2R)-N-(2-fluorophenyl)-2-methylpiperidine-1-carboxamide
CID 40611905
1-[(2R)-2-[2-(3-hydroxyphenyl)ethyl]piperidin-1-yl]-2-pyridin-3-ylethane-1,2-dione
CID 95477017
N-(2,6-difluorophenyl)-2-ethylpiperidine-1-carboxamide
CID 108990928
(2-amino-4-pyridinyl)-[2-[2-(3-hydroxyphenyl)ethyl]piperidin-1-yl]methanone
CID 70737293
2-(2-hydroxyethyl)-N-naphthalen-1-ylpiperidine-1-carboxamide
CID 4097803
[2-[2-(3-hydroxyphenyl)ethyl]piperidin-1-yl]-[2-(2H-tetrazol-5-yl)phenyl]methanone
CID 70786804
1-[2-[(2S)-2-[2-(3-hydroxyphenyl)ethyl]piperidin-1-yl]-2-oxoethyl]pyrimidin-2-one
CID 95550989
(2S)-2-[2-(3-fluorophenyl)ethyl]pyrrolidine-1-carboxylic acid
CID 90117469
N-(2,6-difluorophenyl)-2-[2-(2-hydroxyethyl)piperidin-1-yl]-2-oxoacetamide
CID 108522156
3-[2-(1-methylpyrrolidin-2-yl)ethyl]phenol
CID 84673587
3-fluoro-2-[[2-(hydroxymethyl)piperidine-1-carbonyl]amino]benzoic acid
CID 81497850

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-[2-(3-hydroxyphenyl)ethyl]piperidine-1-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-2-[2-(3-hydroxyphenyl)ethyl]piperidine-1-carboxamide (CID 56882244) is N-(2-fluorophenyl)-2-[2-(3-hydroxyphenyl)ethyl]piperidine-1-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-2-[2-(3-hydroxyphenyl)ethyl]piperidine-1-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-2-[2-(3-hydroxyphenyl)ethyl]piperidine-1-carboxamide is O=C(Nc1ccccc1F)N1CCCCC1CCc1cccc(O)c1.
What is the InChIKey of N-(2-fluorophenyl)-2-[2-(3-hydroxyphenyl)ethyl]piperidine-1-carboxamide?
The InChIKey is NKEZDUXHPKGVMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FN2O2/c21-18-9-1-2-10-19(18)22-20(25)23-13-4-3-7-16(23)12-11-15-6-5-8-17(24)14-15/h1-2,5-6,8-10,14,16,24H,3-4,7,11-13H2,(H,22,25).
What are the key properties of N-(2-fluorophenyl)-2-[2-(3-hydroxyphenyl)ethyl]piperidine-1-carboxamide?
N-(2-fluorophenyl)-2-[2-(3-hydroxyphenyl)ethyl]piperidine-1-carboxamide has a molecular weight of 342.41 g/mol, XLogP of 4.55, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-2-[2-(3-hydroxyphenyl)ethyl]piperidine-1-carboxamide is sourced from PubChem (CID 56882244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).