4-hydroxy-N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]benzamide

C20H23N3O3 — CID 126243453

IUPAC4-hydroxy-N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]benzamide
SMILESCOc1cc(N2CCCCC2)ccc1/C=N\NC(=O)c1ccc(O)cc1
InChIInChI=1S/C20H23N3O3/c1-26-19-13-17(23-11-3-2-4-12-23)8-5-16(19)14-21-22-20(25)15-6-9-18(24)10-7-15/h5-10,13-14,24H,2-4,11-12H2,1H3,(H,22,25)/b21-14-
InChIKeyJDJHFFMIQJKFET-STZFKDTASA-N
MW353.42 g/mol
LogP3.15
Rot. Bonds5

About 4-hydroxy-N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]benzamide

4-hydroxy-N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]benzamide (PubChem CID 126243453) has the molecular formula C20H23N3O3 and a molecular weight of 353.42 g/mol. Its IUPAC name is 4-hydroxy-N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]benzamide.

Molecular Properties

Compound Name4-hydroxy-N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]benzamide
PubChem CID126243453
Molecular FormulaC20H23N3O3
Molecular Weight353.42 g/mol
Exact Mass353.17
IUPAC Name4-hydroxy-N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]benzamide
SMILESCOc1cc(N2CCCCC2)ccc1/C=N\NC(=O)c1ccc(O)cc1
InChIInChI=1S/C20H23N3O3/c1-26-19-13-17(23-11-3-2-4-12-23)8-5-16(19)14-21-22-20(25)15-6-9-18(24)10-7-15/h5-10,13-14,24H,2-4,11-12H2,1H3,(H,22,25)/b21-14-
InChIKeyJDJHFFMIQJKFET-STZFKDTASA-N
XLogP3.15
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.42
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]-3-(trifluoromethyl)benzamide
CID 126246937
4-[(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]phenol
CID 126239963
4-chloro-N-[(4-hydroxy-2-methoxyphenyl)methylideneamino]benzamide
CID 691020
N-[(Z)-(2-hydroxy-3-methoxy-5-nitrophenyl)methylideneamino]-4-pyrrolidin-1-ylbenzamide
CID 135818924
5-bromo-7-methoxy-N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]-1-benzofuran-2-carboxamide
CID 126253070
1-ethyl-3-[(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]thiourea
CID 4545514
1-[4-[(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]phenyl]ethanone
CID 126236474
2-hydroxy-N-[(Z)-(2-methoxy-4-morpholin-4-ylphenyl)methylideneamino]benzamide
CID 6056382
N-[(Z)-(2-methoxy-4-morpholin-4-ylphenyl)methylideneamino]-3-(trifluoromethyl)benzamide
CID 126230211
N-[(2,5-dimethoxyphenyl)methylideneamino]-4-hydroxybenzamide
CID 4193667
N-[(E)-(4-hydroxy-3-methoxy-5-nitrophenyl)methylideneamino]-4-pyrrolidin-1-ylbenzamide
CID 135818915
2-methoxy-4-piperidin-1-ylbenzaldehyde
CID 3156699

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]benzamide?
The IUPAC name of 4-hydroxy-N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]benzamide (CID 126243453) is 4-hydroxy-N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]benzamide.
What is the SMILES notation for 4-hydroxy-N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]benzamide?
The canonical SMILES for 4-hydroxy-N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]benzamide is COc1cc(N2CCCCC2)ccc1/C=N\NC(=O)c1ccc(O)cc1.
What is the InChIKey of 4-hydroxy-N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]benzamide?
The InChIKey is JDJHFFMIQJKFET-STZFKDTASA-N. The full InChI is InChI=1S/C20H23N3O3/c1-26-19-13-17(23-11-3-2-4-12-23)8-5-16(19)14-21-22-20(25)15-6-9-18(24)10-7-15/h5-10,13-14,24H,2-4,11-12H2,1H3,(H,22,25)/b21-14-.
What are the key properties of 4-hydroxy-N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]benzamide?
4-hydroxy-N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]benzamide has a molecular weight of 353.42 g/mol, XLogP of 3.15, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[(Z)-(2-methoxy-4-piperidin-1-ylphenyl)methylideneamino]benzamide is sourced from PubChem (CID 126243453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).