N-hydroxy-4-[[[1-(4-methoxyphenyl)-2-oxopropyl]amino]methyl]benzamide

C18H20N2O4 — CID 174763161

IUPACN-hydroxy-4-[[[1-(4-methoxyphenyl)-2-oxopropyl]amino]methyl]benzamide
SMILESCOc1ccc(C(NCc2ccc(C(=O)NO)cc2)C(C)=O)cc1
InChIInChI=1S/C18H20N2O4/c1-12(21)17(14-7-9-16(24-2)10-8-14)19-11-13-3-5-15(6-4-13)18(22)20-23/h3-10,17,19,23H,11H2,1-2H3,(H,20,22)
InChIKeyJDRXBCFJCILAJK-UHFFFAOYSA-N
MW328.37 g/mol
LogP2.23
Rot. Bonds7

About N-hydroxy-4-[[[1-(4-methoxyphenyl)-2-oxopropyl]amino]methyl]benzamide

N-hydroxy-4-[[[1-(4-methoxyphenyl)-2-oxopropyl]amino]methyl]benzamide (PubChem CID 174763161) has the molecular formula C18H20N2O4 and a molecular weight of 328.37 g/mol. Its IUPAC name is N-hydroxy-4-[[[1-(4-methoxyphenyl)-2-oxopropyl]amino]methyl]benzamide.

Molecular Properties

Compound NameN-hydroxy-4-[[[1-(4-methoxyphenyl)-2-oxopropyl]amino]methyl]benzamide
PubChem CID174763161
Molecular FormulaC18H20N2O4
Molecular Weight328.37 g/mol
Exact Mass328.14
IUPAC NameN-hydroxy-4-[[[1-(4-methoxyphenyl)-2-oxopropyl]amino]methyl]benzamide
SMILESCOc1ccc(C(NCc2ccc(C(=O)NO)cc2)C(C)=O)cc1
InChIInChI=1S/C18H20N2O4/c1-12(21)17(14-7-9-16(24-2)10-8-14)19-11-13-3-5-15(6-4-13)18(22)20-23/h3-10,17,19,23H,11H2,1-2H3,(H,20,22)
InChIKeyJDRXBCFJCILAJK-UHFFFAOYSA-N
XLogP2.23
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 52.23
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

(2R)-2-(benzylamino)-2-(4-methoxyphenyl)acetic acid
CID 10612160
N-hydroxy-4-[(1R)-1-[(4-methoxybenzoyl)amino]ethyl]benzamide
CID 58417539
N-benzyl-2-[(4-methoxyphenyl)methylamino]-2-phenylacetamide
CID 68961679
(2R)-2-[(4-methoxyphenyl)methylamino]-2-phenyl-N-propan-2-ylacetamide
CID 94640724
methyl 4-[isocyano-[(4-methoxyphenyl)methylamino]methyl]benzoate
CID 59830245
2-(4-methoxyphenyl)-2-[[4-(propan-2-ylcarbamoyl)benzoyl]amino]acetic acid
CID 120530324
1-(4-aminophenyl)-2-[(4-methoxyphenyl)methylamino]butan-1-one
CID 82258145
N-[(4-methoxyphenyl)methylcarbamothioyl]-4-propan-2-ylbenzamide
CID 17230602
methyl 2-[(4-methoxyphenyl)methylamino]propanoate
CID 60780821
2-[(4-methoxyphenyl)methylamino]-1-(4-methylphenyl)propan-1-one
CID 82100112
N-hydroxy-4-[[[2-(3-methoxyphenyl)acetyl]amino]methyl]benzamide
CID 90480233
4-[[2-[(6-methoxynaphthalen-2-yl)methyl]hydrazinyl]methyl]-N-propan-2-ylbenzamide
CID 175213138

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-4-[[[1-(4-methoxyphenyl)-2-oxopropyl]amino]methyl]benzamide?
The IUPAC name of N-hydroxy-4-[[[1-(4-methoxyphenyl)-2-oxopropyl]amino]methyl]benzamide (CID 174763161) is N-hydroxy-4-[[[1-(4-methoxyphenyl)-2-oxopropyl]amino]methyl]benzamide.
What is the SMILES notation for N-hydroxy-4-[[[1-(4-methoxyphenyl)-2-oxopropyl]amino]methyl]benzamide?
The canonical SMILES for N-hydroxy-4-[[[1-(4-methoxyphenyl)-2-oxopropyl]amino]methyl]benzamide is COc1ccc(C(NCc2ccc(C(=O)NO)cc2)C(C)=O)cc1.
What is the InChIKey of N-hydroxy-4-[[[1-(4-methoxyphenyl)-2-oxopropyl]amino]methyl]benzamide?
The InChIKey is JDRXBCFJCILAJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O4/c1-12(21)17(14-7-9-16(24-2)10-8-14)19-11-13-3-5-15(6-4-13)18(22)20-23/h3-10,17,19,23H,11H2,1-2H3,(H,20,22).
What are the key properties of N-hydroxy-4-[[[1-(4-methoxyphenyl)-2-oxopropyl]amino]methyl]benzamide?
N-hydroxy-4-[[[1-(4-methoxyphenyl)-2-oxopropyl]amino]methyl]benzamide has a molecular weight of 328.37 g/mol, XLogP of 2.23, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-4-[[[1-(4-methoxyphenyl)-2-oxopropyl]amino]methyl]benzamide is sourced from PubChem (CID 174763161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).