2-acetyl-N-hydroxy-3-methoxybenzamide

C10H11NO4 — CID 125496951

IUPAC2-acetyl-N-hydroxy-3-methoxybenzamide
SMILESCOc1cccc(C(=O)NO)c1C(C)=O
InChIInChI=1S/C10H11NO4/c1-6(12)9-7(10(13)11-14)4-3-5-8(9)15-2/h3-5,14H,1-2H3,(H,11,13)
InChIKeyBCMNMVSNXRSCHF-UHFFFAOYSA-N
MW209.20 g/mol
LogP1.02
Rot. Bonds3

About 2-acetyl-N-hydroxy-3-methoxybenzamide

2-acetyl-N-hydroxy-3-methoxybenzamide (PubChem CID 125496951) has the molecular formula C10H11NO4 and a molecular weight of 209.20 g/mol. Its IUPAC name is 2-acetyl-N-hydroxy-3-methoxybenzamide.

Molecular Properties

Compound Name2-acetyl-N-hydroxy-3-methoxybenzamide
PubChem CID125496951
Molecular FormulaC10H11NO4
Molecular Weight209.20 g/mol
Exact Mass209.07
IUPAC Name2-acetyl-N-hydroxy-3-methoxybenzamide
SMILESCOc1cccc(C(=O)NO)c1C(C)=O
InChIInChI=1S/C10H11NO4/c1-6(12)9-7(10(13)11-14)4-3-5-8(9)15-2/h3-5,14H,1-2H3,(H,11,13)
InChIKeyBCMNMVSNXRSCHF-UHFFFAOYSA-N
XLogP1.02
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

2-acetyl-N,N-diethyl-3-methoxybenzamide
CID 19802545
1-(2-chloro-6-methoxyphenyl)ethanone
CID 71464357
(2-acetyl-3-methoxyphenyl) acetate
CID 15090735
1-[2-(chloroamino)-3-methoxyphenyl]ethanone
CID 174727261
(2-acetyl-3-methoxyphenyl) methanesulfonate
CID 100978812
N-(2-acetyl-6-methoxyphenyl)acetamide
CID 117295660
2,6-dimethoxy-N-[2-[(2-methoxybenzoyl)amino]ethyl]benzamide
CID 108538022
formaldehyde;bis(1-(2-methoxyphenyl)ethanone)
CID 174959963
2,6-dimethoxybenzohydrazide
CID 2806104
N-ethanethioyl-2,6-dimethoxybenzamide
CID 849614
2,3-dihydroxy-N'-(2-hydroxy-3-methoxybenzoyl)benzohydrazide
CID 24773714
1-[2-(4-bromophenyl)-6-methoxyphenyl]ethanone
CID 132510284

Frequently Asked Questions

What is the IUPAC name of 2-acetyl-N-hydroxy-3-methoxybenzamide?
The IUPAC name of 2-acetyl-N-hydroxy-3-methoxybenzamide (CID 125496951) is 2-acetyl-N-hydroxy-3-methoxybenzamide.
What is the SMILES notation for 2-acetyl-N-hydroxy-3-methoxybenzamide?
The canonical SMILES for 2-acetyl-N-hydroxy-3-methoxybenzamide is COc1cccc(C(=O)NO)c1C(C)=O.
What is the InChIKey of 2-acetyl-N-hydroxy-3-methoxybenzamide?
The InChIKey is BCMNMVSNXRSCHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO4/c1-6(12)9-7(10(13)11-14)4-3-5-8(9)15-2/h3-5,14H,1-2H3,(H,11,13).
What are the key properties of 2-acetyl-N-hydroxy-3-methoxybenzamide?
2-acetyl-N-hydroxy-3-methoxybenzamide has a molecular weight of 209.20 g/mol, XLogP of 1.02, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetyl-N-hydroxy-3-methoxybenzamide is sourced from PubChem (CID 125496951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).