N-hydroxy-4-[[3-[(4-methoxybenzoyl)amino]phenoxy]methyl]benzamide

C22H20N2O5 — CID 153407823

IUPACN-hydroxy-4-[[3-[(4-methoxybenzoyl)amino]phenoxy]methyl]benzamide
SMILESCOc1ccc(C(=O)Nc2cccc(OCc3ccc(C(=O)NO)cc3)c2)cc1
InChIInChI=1S/C22H20N2O5/c1-28-19-11-9-16(10-12-19)21(25)23-18-3-2-4-20(13-18)29-14-15-5-7-17(8-6-15)22(26)24-27/h2-13,27H,14H2,1H3,(H,23,25)(H,24,26)
InChIKeyJLDFVORUEDIQBD-UHFFFAOYSA-N
MW392.41 g/mol
LogP3.65
Rot. Bonds7

About N-hydroxy-4-[[3-[(4-methoxybenzoyl)amino]phenoxy]methyl]benzamide

N-hydroxy-4-[[3-[(4-methoxybenzoyl)amino]phenoxy]methyl]benzamide (PubChem CID 153407823) has the molecular formula C22H20N2O5 and a molecular weight of 392.41 g/mol. Its IUPAC name is N-hydroxy-4-[[3-[(4-methoxybenzoyl)amino]phenoxy]methyl]benzamide.

Molecular Properties

Compound NameN-hydroxy-4-[[3-[(4-methoxybenzoyl)amino]phenoxy]methyl]benzamide
PubChem CID153407823
Molecular FormulaC22H20N2O5
Molecular Weight392.41 g/mol
Exact Mass392.14
IUPAC NameN-hydroxy-4-[[3-[(4-methoxybenzoyl)amino]phenoxy]methyl]benzamide
SMILESCOc1ccc(C(=O)Nc2cccc(OCc3ccc(C(=O)NO)cc3)c2)cc1
InChIInChI=1S/C22H20N2O5/c1-28-19-11-9-16(10-12-19)21(25)23-18-3-2-4-20(13-18)29-14-15-5-7-17(8-6-15)22(26)24-27/h2-13,27H,14H2,1H3,(H,23,25)(H,24,26)
InChIKeyJLDFVORUEDIQBD-UHFFFAOYSA-N
XLogP3.65
TPSA96.89 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.41
LogP ≤ 53.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-methoxy-N-(3-phenylmethoxyphenyl)benzamide
CID 135564193
4-(2-phenoxyethoxy)-N-(3-phenylmethoxyphenyl)benzamide
CID 17086099
4-(aminomethyl)-N-(3-methoxyphenyl)benzamide
CID 16796099
N-[3-(cyanomethoxy)phenyl]-4-methoxybenzamide
CID 43369186
N-(3-phenylmethoxyphenyl)-4-propoxybenzamide
CID 17086082
N-[3-[[4-(hydroxymethyl)phenyl]methoxy]phenyl]benzamide
CID 110006010
N-[3-[2-(4-methoxyphenyl)-2-oxoethoxy]phenyl]-4-methylbenzamide
CID 19644977
4-phenylmethoxy-N-(3-prop-2-enoxyphenyl)benzamide
CID 17086755
4-[(4-chlorophenyl)methoxy]-3-methoxy-N-(3-methoxyphenyl)benzamide
CID 4614010
4-[(3-acetamidophenoxy)methyl]benzoic acid
CID 28829525
2,4-dimethoxy-N-(3-phenylmethoxyphenyl)benzamide
CID 54790493
3-[[4-[(4-fluorophenyl)methoxy]benzoyl]amino]benzoic acid
CID 139501079

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[[3-[(4-methoxybenzoyl)amino]phenoxy]methyl]benzamide?
The IUPAC name of N-hydroxy-4-[[3-[(4-methoxybenzoyl)amino]phenoxy]methyl]benzamide (CID 153407823) is N-hydroxy-4-[[3-[(4-methoxybenzoyl)amino]phenoxy]methyl]benzamide.
What is the SMILES notation for N-hydroxy-4-[[3-[(4-methoxybenzoyl)amino]phenoxy]methyl]benzamide?
The canonical SMILES for N-hydroxy-4-[[3-[(4-methoxybenzoyl)amino]phenoxy]methyl]benzamide is COc1ccc(C(=O)Nc2cccc(OCc3ccc(C(=O)NO)cc3)c2)cc1.
What is the InChIKey of N-hydroxy-4-[[3-[(4-methoxybenzoyl)amino]phenoxy]methyl]benzamide?
The InChIKey is JLDFVORUEDIQBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O5/c1-28-19-11-9-16(10-12-19)21(25)23-18-3-2-4-20(13-18)29-14-15-5-7-17(8-6-15)22(26)24-27/h2-13,27H,14H2,1H3,(H,23,25)(H,24,26).
What are the key properties of N-hydroxy-4-[[3-[(4-methoxybenzoyl)amino]phenoxy]methyl]benzamide?
N-hydroxy-4-[[3-[(4-methoxybenzoyl)amino]phenoxy]methyl]benzamide has a molecular weight of 392.41 g/mol, XLogP of 3.65, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[[3-[(4-methoxybenzoyl)amino]phenoxy]methyl]benzamide is sourced from PubChem (CID 153407823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).