3-[(4-ethoxybenzoyl)amino]-N-hydroxy-4-methoxybenzamide

C17H18N2O5 — CID 127047412

IUPAC3-[(4-ethoxybenzoyl)amino]-N-hydroxy-4-methoxybenzamide
SMILESCCOc1ccc(C(=O)Nc2cc(C(=O)NO)ccc2OC)cc1
InChIInChI=1S/C17H18N2O5/c1-3-24-13-7-4-11(5-8-13)16(20)18-14-10-12(17(21)19-22)6-9-15(14)23-2/h4-10,22H,3H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyKZDIIWXOZJOZET-UHFFFAOYSA-N
MW330.34 g/mol
LogP2.47
Rot. Bonds6

About 3-[(4-ethoxybenzoyl)amino]-N-hydroxy-4-methoxybenzamide

3-[(4-ethoxybenzoyl)amino]-N-hydroxy-4-methoxybenzamide (PubChem CID 127047412) has the molecular formula C17H18N2O5 and a molecular weight of 330.34 g/mol. Its IUPAC name is 3-[(4-ethoxybenzoyl)amino]-N-hydroxy-4-methoxybenzamide.

Molecular Properties

Compound Name3-[(4-ethoxybenzoyl)amino]-N-hydroxy-4-methoxybenzamide
PubChem CID127047412
Molecular FormulaC17H18N2O5
Molecular Weight330.34 g/mol
Exact Mass330.12
IUPAC Name3-[(4-ethoxybenzoyl)amino]-N-hydroxy-4-methoxybenzamide
SMILESCCOc1ccc(C(=O)Nc2cc(C(=O)NO)ccc2OC)cc1
InChIInChI=1S/C17H18N2O5/c1-3-24-13-7-4-11(5-8-13)16(20)18-14-10-12(17(21)19-22)6-9-15(14)23-2/h4-10,22H,3H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyKZDIIWXOZJOZET-UHFFFAOYSA-N
XLogP2.47
TPSA96.89 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.34
LogP ≤ 52.47
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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Frequently Asked Questions

What is the IUPAC name of 3-[(4-ethoxybenzoyl)amino]-N-hydroxy-4-methoxybenzamide?
The IUPAC name of 3-[(4-ethoxybenzoyl)amino]-N-hydroxy-4-methoxybenzamide (CID 127047412) is 3-[(4-ethoxybenzoyl)amino]-N-hydroxy-4-methoxybenzamide.
What is the SMILES notation for 3-[(4-ethoxybenzoyl)amino]-N-hydroxy-4-methoxybenzamide?
The canonical SMILES for 3-[(4-ethoxybenzoyl)amino]-N-hydroxy-4-methoxybenzamide is CCOc1ccc(C(=O)Nc2cc(C(=O)NO)ccc2OC)cc1.
What is the InChIKey of 3-[(4-ethoxybenzoyl)amino]-N-hydroxy-4-methoxybenzamide?
The InChIKey is KZDIIWXOZJOZET-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O5/c1-3-24-13-7-4-11(5-8-13)16(20)18-14-10-12(17(21)19-22)6-9-15(14)23-2/h4-10,22H,3H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of 3-[(4-ethoxybenzoyl)amino]-N-hydroxy-4-methoxybenzamide?
3-[(4-ethoxybenzoyl)amino]-N-hydroxy-4-methoxybenzamide has a molecular weight of 330.34 g/mol, XLogP of 2.47, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-ethoxybenzoyl)amino]-N-hydroxy-4-methoxybenzamide is sourced from PubChem (CID 127047412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).