N'-(4-butoxy-3-methoxybenzoyl)-2-hydroxy-4-methylbenzohydrazide

C20H24N2O5 — CID 31715670

IUPACN'-(4-butoxy-3-methoxybenzoyl)-2-hydroxy-4-methylbenzohydrazide
SMILESCCCCOc1ccc(C(=O)NNC(=O)c2ccc(C)cc2O)cc1OC
InChIInChI=1S/C20H24N2O5/c1-4-5-10-27-17-9-7-14(12-18(17)26-3)19(24)21-22-20(25)15-8-6-13(2)11-16(15)23/h6-9,11-12,23H,4-5,10H2,1-3H3,(H,21,24)(H,22,25)
InChIKeyABUGJNHHXKVRAA-UHFFFAOYSA-N
MW372.42 g/mol
LogP2.96
Rot. Bonds7

About N'-(4-butoxy-3-methoxybenzoyl)-2-hydroxy-4-methylbenzohydrazide

N'-(4-butoxy-3-methoxybenzoyl)-2-hydroxy-4-methylbenzohydrazide (PubChem CID 31715670) has the molecular formula C20H24N2O5 and a molecular weight of 372.42 g/mol. Its IUPAC name is N'-(4-butoxy-3-methoxybenzoyl)-2-hydroxy-4-methylbenzohydrazide.

Molecular Properties

Compound NameN'-(4-butoxy-3-methoxybenzoyl)-2-hydroxy-4-methylbenzohydrazide
PubChem CID31715670
Molecular FormulaC20H24N2O5
Molecular Weight372.42 g/mol
Exact Mass372.17
IUPAC NameN'-(4-butoxy-3-methoxybenzoyl)-2-hydroxy-4-methylbenzohydrazide
SMILESCCCCOc1ccc(C(=O)NNC(=O)c2ccc(C)cc2O)cc1OC
InChIInChI=1S/C20H24N2O5/c1-4-5-10-27-17-9-7-14(12-18(17)26-3)19(24)21-22-20(25)15-8-6-13(2)11-16(15)23/h6-9,11-12,23H,4-5,10H2,1-3H3,(H,21,24)(H,22,25)
InChIKeyABUGJNHHXKVRAA-UHFFFAOYSA-N
XLogP2.96
TPSA96.89 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 52.96
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N'-(4-butoxy-3-methoxybenzoyl)-2,5-dimethylfuran-3-carbohydrazide
CID 26784336
N'-(4-butoxy-3-methoxybenzoyl)-3-ethoxy-4-methoxybenzohydrazide
CID 24553442
N'-benzoyl-4-butoxy-3-methoxybenzohydrazide
CID 9440054
N'-(4-butoxy-3-methoxybenzoyl)naphthalene-1-carbohydrazide
CID 26621633
N'-(4-butoxy-3-methoxybenzoyl)-3,4,5-triethoxybenzohydrazide
CID 25442347
2,3,4-trimethoxy-N'-(3-methoxy-4-propoxybenzoyl)benzohydrazide
CID 9440197
N'-(4-butoxy-3-methoxybenzoyl)-2-methyl-6-phenylpyridine-3-carbohydrazide
CID 24531698
N'-(4-butoxy-3-methoxybenzoyl)furan-3-carbohydrazide
CID 25442733
N'-(4-butoxy-3-methoxybenzoyl)-3,4,5-trimethoxy-2-nitrobenzohydrazide
CID 24514989
4-butoxy-N-(2-fluoro-4-methylphenyl)-3-methoxybenzamide
CID 26522911
N'-[(E)-3-(4-butoxy-3-methoxyphenyl)prop-2-enoyl]-4-methylbenzohydrazide
CID 9475903
4-butoxy-N'-(3-cyanobenzoyl)-3-methoxybenzohydrazide
CID 9440115

Frequently Asked Questions

What is the IUPAC name of N'-(4-butoxy-3-methoxybenzoyl)-2-hydroxy-4-methylbenzohydrazide?
The IUPAC name of N'-(4-butoxy-3-methoxybenzoyl)-2-hydroxy-4-methylbenzohydrazide (CID 31715670) is N'-(4-butoxy-3-methoxybenzoyl)-2-hydroxy-4-methylbenzohydrazide.
What is the SMILES notation for N'-(4-butoxy-3-methoxybenzoyl)-2-hydroxy-4-methylbenzohydrazide?
The canonical SMILES for N'-(4-butoxy-3-methoxybenzoyl)-2-hydroxy-4-methylbenzohydrazide is CCCCOc1ccc(C(=O)NNC(=O)c2ccc(C)cc2O)cc1OC.
What is the InChIKey of N'-(4-butoxy-3-methoxybenzoyl)-2-hydroxy-4-methylbenzohydrazide?
The InChIKey is ABUGJNHHXKVRAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O5/c1-4-5-10-27-17-9-7-14(12-18(17)26-3)19(24)21-22-20(25)15-8-6-13(2)11-16(15)23/h6-9,11-12,23H,4-5,10H2,1-3H3,(H,21,24)(H,22,25).
What are the key properties of N'-(4-butoxy-3-methoxybenzoyl)-2-hydroxy-4-methylbenzohydrazide?
N'-(4-butoxy-3-methoxybenzoyl)-2-hydroxy-4-methylbenzohydrazide has a molecular weight of 372.42 g/mol, XLogP of 2.96, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-butoxy-3-methoxybenzoyl)-2-hydroxy-4-methylbenzohydrazide is sourced from PubChem (CID 31715670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).