N-[6-(4-fluorophenoxy)-3-pyridinyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide

C24H24FN3O3 — CID 55743984

IUPACN-[6-(4-fluorophenoxy)-3-pyridinyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide
SMILESO=C(Nc1ccc(Oc2ccc(F)cc2)nc1)N1CCC(C(O)c2ccccc2)CC1
InChIInChI=1S/C24H24FN3O3/c25-19-6-9-21(10-7-19)31-22-11-8-20(16-26-22)27-24(30)28-14-12-18(13-15-28)23(29)17-4-2-1-3-5-17/h1-11,16,18,23,29H,12-15H2,(H,27,30)
InChIKeyYJQXSENRTSQORN-UHFFFAOYSA-N
MW421.47 g/mol
LogP4.99
Rot. Bonds5

About N-[6-(4-fluorophenoxy)-3-pyridinyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide

N-[6-(4-fluorophenoxy)-3-pyridinyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide (PubChem CID 55743984) has the molecular formula C24H24FN3O3 and a molecular weight of 421.47 g/mol. Its IUPAC name is N-[6-(4-fluorophenoxy)-3-pyridinyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-[6-(4-fluorophenoxy)-3-pyridinyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide
PubChem CID55743984
Molecular FormulaC24H24FN3O3
Molecular Weight421.47 g/mol
Exact Mass421.18
IUPAC NameN-[6-(4-fluorophenoxy)-3-pyridinyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide
SMILESO=C(Nc1ccc(Oc2ccc(F)cc2)nc1)N1CCC(C(O)c2ccccc2)CC1
InChIInChI=1S/C24H24FN3O3/c25-19-6-9-21(10-7-19)31-22-11-8-20(16-26-22)27-24(30)28-14-12-18(13-15-28)23(29)17-4-2-1-3-5-17/h1-11,16,18,23,29H,12-15H2,(H,27,30)
InChIKeyYJQXSENRTSQORN-UHFFFAOYSA-N
XLogP4.99
TPSA74.69 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.47
LogP ≤ 54.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(S)-hydroxy(phenyl)methyl]-N-phenylpiperidine-1-carboxamide
CID 51547304
1-[[6-(4-chlorophenoxy)-3-pyridinyl]carbamoyl]piperidine-4-carboxylic acid
CID 122078011
N-(4-chlorophenyl)-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide
CID 110884355
N-[6-(4-fluorophenoxy)-3-pyridinyl]-4-(furan-2-carbonyl)piperazine-1-carboxamide
CID 52627337
4-(2-hydroxy-2-phenylethyl)-N-[4-[(5-methyl-2-pyridinyl)oxy]phenyl]piperazine-1-carboxamide
CID 86974702
4-cyclopropyl-N-[6-(4-methylphenoxy)-3-pyridinyl]piperazine-1-carboxamide
CID 127348584
N-[6-(4-fluorophenoxy)-3-pyridinyl]cyclopropanecarboxamide
CID 117059029
N-[6-(4-fluorophenoxy)-3-pyridinyl]-4-(pyridin-3-ylmethyl)piperazine-1-carboxamide
CID 55743828
N-[6-(4-fluorophenoxy)-3-pyridinyl]-2-(hydroxymethyl)piperidine-1-carboxamide
CID 71845869
1-[[4-[(5-chloro-2-pyridinyl)oxy]phenyl]carbamoyl]piperidine-4-carboxylic acid
CID 122085769
1-[[6-(2,3-difluorophenoxy)-3-pyridinyl]carbamoyl]piperidine-4-carboxylic acid
CID 122091824
N-(dicyclopropylmethyl)-4-[(4-fluorophenyl)-hydroxymethyl]piperidine-1-carboxamide
CID 111109553

Frequently Asked Questions

What is the IUPAC name of N-[6-(4-fluorophenoxy)-3-pyridinyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide?
The IUPAC name of N-[6-(4-fluorophenoxy)-3-pyridinyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide (CID 55743984) is N-[6-(4-fluorophenoxy)-3-pyridinyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide.
What is the SMILES notation for N-[6-(4-fluorophenoxy)-3-pyridinyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide?
The canonical SMILES for N-[6-(4-fluorophenoxy)-3-pyridinyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide is O=C(Nc1ccc(Oc2ccc(F)cc2)nc1)N1CCC(C(O)c2ccccc2)CC1.
What is the InChIKey of N-[6-(4-fluorophenoxy)-3-pyridinyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide?
The InChIKey is YJQXSENRTSQORN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24FN3O3/c25-19-6-9-21(10-7-19)31-22-11-8-20(16-26-22)27-24(30)28-14-12-18(13-15-28)23(29)17-4-2-1-3-5-17/h1-11,16,18,23,29H,12-15H2,(H,27,30).
What are the key properties of N-[6-(4-fluorophenoxy)-3-pyridinyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide?
N-[6-(4-fluorophenoxy)-3-pyridinyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide has a molecular weight of 421.47 g/mol, XLogP of 4.99, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(4-fluorophenoxy)-3-pyridinyl]-4-[hydroxy(phenyl)methyl]piperidine-1-carboxamide is sourced from PubChem (CID 55743984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).