4-hydroxy-3-(2-oxo-4-phenylmethoxy-1-pyridinyl)piperidine-1-carboxylic acid

C18H20N2O5 — CID 22128556

IUPAC4-hydroxy-3-(2-oxo-4-phenylmethoxy-1-pyridinyl)piperidine-1-carboxylic acid
SMILESO=C(O)N1CCC(O)C(n2ccc(OCc3ccccc3)cc2=O)C1
InChIInChI=1S/C18H20N2O5/c21-16-7-8-19(18(23)24)11-15(16)20-9-6-14(10-17(20)22)25-12-13-4-2-1-3-5-13/h1-6,9-10,15-16,21H,7-8,11-12H2,(H,23,24)
InChIKeyWNNFEUWCZUUKJZ-UHFFFAOYSA-N
MW344.37 g/mol
LogP1.71
Rot. Bonds4

About 4-hydroxy-3-(2-oxo-4-phenylmethoxy-1-pyridinyl)piperidine-1-carboxylic acid

4-hydroxy-3-(2-oxo-4-phenylmethoxy-1-pyridinyl)piperidine-1-carboxylic acid (PubChem CID 22128556) has the molecular formula C18H20N2O5 and a molecular weight of 344.37 g/mol. Its IUPAC name is 4-hydroxy-3-(2-oxo-4-phenylmethoxy-1-pyridinyl)piperidine-1-carboxylic acid.

Molecular Properties

Compound Name4-hydroxy-3-(2-oxo-4-phenylmethoxy-1-pyridinyl)piperidine-1-carboxylic acid
PubChem CID22128556
Molecular FormulaC18H20N2O5
Molecular Weight344.37 g/mol
Exact Mass344.14
IUPAC Name4-hydroxy-3-(2-oxo-4-phenylmethoxy-1-pyridinyl)piperidine-1-carboxylic acid
SMILESO=C(O)N1CCC(O)C(n2ccc(OCc3ccccc3)cc2=O)C1
InChIInChI=1S/C18H20N2O5/c21-16-7-8-19(18(23)24)11-15(16)20-9-6-14(10-17(20)22)25-12-13-4-2-1-3-5-13/h1-6,9-10,15-16,21H,7-8,11-12H2,(H,23,24)
InChIKeyWNNFEUWCZUUKJZ-UHFFFAOYSA-N
XLogP1.71
TPSA92.00 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

tert-butyl 4-hydroxy-3-(2-oxo-4-phenylmethoxy-1-pyridinyl)piperidine-1-carboxylate
CID 54475582
[(2R,3S,4R,5R)-3,4-dihydroxy-5-(2-oxo-4-phenylmethoxy-1-pyridinyl)oxolan-2-yl]methyl dihydrogen phosphate
CID 169434798
1-[2-[5-(aminomethyl)-2-pyridinyl]-2-oxoethyl]-4-phenylmethoxypyridin-2-one
CID 143850273
1-[4-(2-oxo-4-phenylmethoxy-1-pyridinyl)phenyl]piperidine-4-carboxamide
CID 24780737
(3aS,6aS)-1-(5-phenylmethoxy-3-pyridinyl)-2,3,3a,4,6,6a-hexahydropyrrolo[2,3-c]pyrrole-5-carboxylic acid
CID 68695924
4-[(3-phenylmethoxyphenyl)methyl]piperazine-1-carboxylic acid
CID 68724845
3-hydroxy-4-(4-phenylmethoxyphenyl)sulfanylpyrrolidine-1-carboxylic acid
CID 18425839
1-[(1S,2S)-2-hydroxycyclohexyl]-4-[2-[(4-phenoxyphenyl)methoxy]phenyl]pyridin-2-one
CID 127028319
1-(4-bromophenyl)-4-phenylmethoxypyridin-2-one
CID 59187025
1-benzyl-3-oxo-2,3a,4,5,7,7a-hexahydropyrrolo[2,3-c]pyridine-6-carboxylic acid
CID 175210645
(2R)-2-(4-phenylmethoxyphenyl)morpholine-4-carboxylic acid
CID 68617082
benzyl 4,5-dihydroxyazepane-1-carboxylate
CID 77454626

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-3-(2-oxo-4-phenylmethoxy-1-pyridinyl)piperidine-1-carboxylic acid?
The IUPAC name of 4-hydroxy-3-(2-oxo-4-phenylmethoxy-1-pyridinyl)piperidine-1-carboxylic acid (CID 22128556) is 4-hydroxy-3-(2-oxo-4-phenylmethoxy-1-pyridinyl)piperidine-1-carboxylic acid.
What is the SMILES notation for 4-hydroxy-3-(2-oxo-4-phenylmethoxy-1-pyridinyl)piperidine-1-carboxylic acid?
The canonical SMILES for 4-hydroxy-3-(2-oxo-4-phenylmethoxy-1-pyridinyl)piperidine-1-carboxylic acid is O=C(O)N1CCC(O)C(n2ccc(OCc3ccccc3)cc2=O)C1.
What is the InChIKey of 4-hydroxy-3-(2-oxo-4-phenylmethoxy-1-pyridinyl)piperidine-1-carboxylic acid?
The InChIKey is WNNFEUWCZUUKJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O5/c21-16-7-8-19(18(23)24)11-15(16)20-9-6-14(10-17(20)22)25-12-13-4-2-1-3-5-13/h1-6,9-10,15-16,21H,7-8,11-12H2,(H,23,24).
What are the key properties of 4-hydroxy-3-(2-oxo-4-phenylmethoxy-1-pyridinyl)piperidine-1-carboxylic acid?
4-hydroxy-3-(2-oxo-4-phenylmethoxy-1-pyridinyl)piperidine-1-carboxylic acid has a molecular weight of 344.37 g/mol, XLogP of 1.71, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-3-(2-oxo-4-phenylmethoxy-1-pyridinyl)piperidine-1-carboxylic acid is sourced from PubChem (CID 22128556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).