N-(3-fluorophenyl)-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide

C17H18FN3O2 — CID 1446453

IUPACN-(3-fluorophenyl)-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide
SMILESO=C(Nc1cccc(F)c1)N1CCC(O)(c2cccnc2)CC1
InChIInChI=1S/C17H18FN3O2/c18-14-4-1-5-15(11-14)20-16(22)21-9-6-17(23,7-10-21)13-3-2-8-19-12-13/h1-5,8,11-12,23H,6-7,9-10H2,(H,20,22)
InChIKeyWOAKONALKLQCLF-UHFFFAOYSA-N
MW315.35 g/mol
LogP2.74
Rot. Bonds2

About N-(3-fluorophenyl)-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide

N-(3-fluorophenyl)-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide (PubChem CID 1446453) has the molecular formula C17H18FN3O2 and a molecular weight of 315.35 g/mol. Its IUPAC name is N-(3-fluorophenyl)-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide
PubChem CID1446453
Molecular FormulaC17H18FN3O2
Molecular Weight315.35 g/mol
Exact Mass315.14
IUPAC NameN-(3-fluorophenyl)-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide
SMILESO=C(Nc1cccc(F)c1)N1CCC(O)(c2cccnc2)CC1
InChIInChI=1S/C17H18FN3O2/c18-14-4-1-5-15(11-14)20-16(22)21-9-6-17(23,7-10-21)13-3-2-8-19-12-13/h1-5,8,11-12,23H,6-7,9-10H2,(H,20,22)
InChIKeyWOAKONALKLQCLF-UHFFFAOYSA-N
XLogP2.74
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.35
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-chloro-3-pyridinyl)-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide
CID 72877334
N-(3-fluorophenyl)pyrrolidine-1-carboxamide
CID 6469622
N-benzyl-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide
CID 1446435
N-(3-fluorophenyl)-4-hydroxy-4-pentylpiperidine-1-carboxamide
CID 23071817
cyclobutyl-(4-hydroxy-4-pyridin-3-ylpiperidin-1-yl)methanone
CID 95833425
N-(3-chloro-5-fluorophenyl)-4-(4-fluorophenyl)-4-hydroxypiperidine-1-carboxamide
CID 23072136
phenyl 2-[(3-fluorophenyl)carbamoyl]-2,7-diazaspiro[3.5]nonane-7-carboxylate
CID 3234315
N-(3-fluorophenyl)-4,4-dimethylpiperazin-4-ium-1-carboxamide
CID 68939615
N-(3-fluorophenyl)-4-sulfamoylpiperazine-1-carboxamide
CID 61131305
9-hydroxy-9-pyridin-3-yl-3-azaspiro[5.5]undecane-3-carboxylic acid
CID 66755240
8-N-(4-fluorophenyl)-2-N-pyridin-3-yl-1-oxa-8-azaspiro[4.5]decane-2,8-dicarboxamide
CID 134076517
3-ethyl-1-[(3-fluorophenyl)carbamoyl]pyrrolidine-3-carboxylic acid
CID 63145789

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide?
The IUPAC name of N-(3-fluorophenyl)-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide (CID 1446453) is N-(3-fluorophenyl)-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide.
What is the SMILES notation for N-(3-fluorophenyl)-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide?
The canonical SMILES for N-(3-fluorophenyl)-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide is O=C(Nc1cccc(F)c1)N1CCC(O)(c2cccnc2)CC1.
What is the InChIKey of N-(3-fluorophenyl)-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide?
The InChIKey is WOAKONALKLQCLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FN3O2/c18-14-4-1-5-15(11-14)20-16(22)21-9-6-17(23,7-10-21)13-3-2-8-19-12-13/h1-5,8,11-12,23H,6-7,9-10H2,(H,20,22).
What are the key properties of N-(3-fluorophenyl)-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide?
N-(3-fluorophenyl)-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide has a molecular weight of 315.35 g/mol, XLogP of 2.74, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-4-hydroxy-4-pyridin-3-ylpiperidine-1-carboxamide is sourced from PubChem (CID 1446453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).