N'-(4-ethoxybenzoyl)-4-(5-methylpyrazol-1-yl)benzohydrazide

C20H20N4O3 — CID 9327686

IUPACN'-(4-ethoxybenzoyl)-4-(5-methylpyrazol-1-yl)benzohydrazide
SMILESCCOc1ccc(C(=O)NNC(=O)c2ccc(-n3nccc3C)cc2)cc1
InChIInChI=1S/C20H20N4O3/c1-3-27-18-10-6-16(7-11-18)20(26)23-22-19(25)15-4-8-17(9-5-15)24-14(2)12-13-21-24/h4-13H,3H2,1-2H3,(H,22,25)(H,23,26)
InChIKeyUNHFOZZLQDJNKE-UHFFFAOYSA-N
MW364.41 g/mol
LogP2.65
Rot. Bonds5

About N'-(4-ethoxybenzoyl)-4-(5-methylpyrazol-1-yl)benzohydrazide

N'-(4-ethoxybenzoyl)-4-(5-methylpyrazol-1-yl)benzohydrazide (PubChem CID 9327686) has the molecular formula C20H20N4O3 and a molecular weight of 364.41 g/mol. Its IUPAC name is N'-(4-ethoxybenzoyl)-4-(5-methylpyrazol-1-yl)benzohydrazide.

Molecular Properties

Compound NameN'-(4-ethoxybenzoyl)-4-(5-methylpyrazol-1-yl)benzohydrazide
PubChem CID9327686
Molecular FormulaC20H20N4O3
Molecular Weight364.41 g/mol
Exact Mass364.15
IUPAC NameN'-(4-ethoxybenzoyl)-4-(5-methylpyrazol-1-yl)benzohydrazide
SMILESCCOc1ccc(C(=O)NNC(=O)c2ccc(-n3nccc3C)cc2)cc1
InChIInChI=1S/C20H20N4O3/c1-3-27-18-10-6-16(7-11-18)20(26)23-22-19(25)15-4-8-17(9-5-15)24-14(2)12-13-21-24/h4-13H,3H2,1-2H3,(H,22,25)(H,23,26)
InChIKeyUNHFOZZLQDJNKE-UHFFFAOYSA-N
XLogP2.65
TPSA85.25 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.41
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-(4-ethoxyphenyl)-4-(5-methylpyrazol-1-yl)benzamide
CID 9043122
N'-(4-ethoxybenzoyl)pyridine-4-carbohydrazide
CID 959949
N-[2-(dimethylamino)-2-oxoethyl]-4-(5-methylpyrazol-1-yl)benzamide
CID 9481086
4-(5-methylpyrazol-1-yl)-N-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]benzamide
CID 55708042
N'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide
CID 18147998
N'-[4-(5-methylpyrazol-1-yl)benzoyl]-1,3-benzodioxole-5-carbohydrazide
CID 9273977
N'-(4-butoxybenzoyl)-4-ethoxybenzohydrazide
CID 7979581
4-(5-methylpyrazol-1-yl)benzoic acid
CID 4962781
3-ethyl-N'-[4-(5-methylpyrazol-1-yl)benzoyl]-4-oxophthalazine-1-carbohydrazide
CID 9369876
N,N-diethyl-4-[[4-(5-methylpyrazol-1-yl)benzoyl]amino]benzamide
CID 9047752
benzyl 2-[[4-(5-methylpyrazol-1-yl)benzoyl]amino]acetate
CID 29209753
4-ethoxy-N'-pyrimidin-2-ylbenzohydrazide
CID 47140397

Frequently Asked Questions

What is the IUPAC name of N'-(4-ethoxybenzoyl)-4-(5-methylpyrazol-1-yl)benzohydrazide?
The IUPAC name of N'-(4-ethoxybenzoyl)-4-(5-methylpyrazol-1-yl)benzohydrazide (CID 9327686) is N'-(4-ethoxybenzoyl)-4-(5-methylpyrazol-1-yl)benzohydrazide.
What is the SMILES notation for N'-(4-ethoxybenzoyl)-4-(5-methylpyrazol-1-yl)benzohydrazide?
The canonical SMILES for N'-(4-ethoxybenzoyl)-4-(5-methylpyrazol-1-yl)benzohydrazide is CCOc1ccc(C(=O)NNC(=O)c2ccc(-n3nccc3C)cc2)cc1.
What is the InChIKey of N'-(4-ethoxybenzoyl)-4-(5-methylpyrazol-1-yl)benzohydrazide?
The InChIKey is UNHFOZZLQDJNKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O3/c1-3-27-18-10-6-16(7-11-18)20(26)23-22-19(25)15-4-8-17(9-5-15)24-14(2)12-13-21-24/h4-13H,3H2,1-2H3,(H,22,25)(H,23,26).
What are the key properties of N'-(4-ethoxybenzoyl)-4-(5-methylpyrazol-1-yl)benzohydrazide?
N'-(4-ethoxybenzoyl)-4-(5-methylpyrazol-1-yl)benzohydrazide has a molecular weight of 364.41 g/mol, XLogP of 2.65, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-ethoxybenzoyl)-4-(5-methylpyrazol-1-yl)benzohydrazide is sourced from PubChem (CID 9327686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).