N'-ethyl-3-methoxy-N'-(4-methylphenyl)benzohydrazide

C17H20N2O2 — CID 9181877

IUPACN'-ethyl-3-methoxy-N'-(4-methylphenyl)benzohydrazide
SMILESCCN(NC(=O)c1cccc(OC)c1)c1ccc(C)cc1
InChIInChI=1S/C17H20N2O2/c1-4-19(15-10-8-13(2)9-11-15)18-17(20)14-6-5-7-16(12-14)21-3/h5-12H,4H2,1-3H3,(H,18,20)
InChIKeyYWAVUSJRUGZGIW-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.17
Rot. Bonds5

About N'-ethyl-3-methoxy-N'-(4-methylphenyl)benzohydrazide

N'-ethyl-3-methoxy-N'-(4-methylphenyl)benzohydrazide (PubChem CID 9181877) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N'-ethyl-3-methoxy-N'-(4-methylphenyl)benzohydrazide.

Molecular Properties

Compound NameN'-ethyl-3-methoxy-N'-(4-methylphenyl)benzohydrazide
PubChem CID9181877
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN'-ethyl-3-methoxy-N'-(4-methylphenyl)benzohydrazide
SMILESCCN(NC(=O)c1cccc(OC)c1)c1ccc(C)cc1
InChIInChI=1S/C17H20N2O2/c1-4-19(15-10-8-13(2)9-11-15)18-17(20)14-6-5-7-16(12-14)21-3/h5-12H,4H2,1-3H3,(H,18,20)
InChIKeyYWAVUSJRUGZGIW-UHFFFAOYSA-N
XLogP3.17
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-ethyl-3-methoxy-N'-(4-methylphenyl)benzohydrazide?
The IUPAC name of N'-ethyl-3-methoxy-N'-(4-methylphenyl)benzohydrazide (CID 9181877) is N'-ethyl-3-methoxy-N'-(4-methylphenyl)benzohydrazide.
What is the SMILES notation for N'-ethyl-3-methoxy-N'-(4-methylphenyl)benzohydrazide?
The canonical SMILES for N'-ethyl-3-methoxy-N'-(4-methylphenyl)benzohydrazide is CCN(NC(=O)c1cccc(OC)c1)c1ccc(C)cc1.
What is the InChIKey of N'-ethyl-3-methoxy-N'-(4-methylphenyl)benzohydrazide?
The InChIKey is YWAVUSJRUGZGIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-4-19(15-10-8-13(2)9-11-15)18-17(20)14-6-5-7-16(12-14)21-3/h5-12H,4H2,1-3H3,(H,18,20).
What are the key properties of N'-ethyl-3-methoxy-N'-(4-methylphenyl)benzohydrazide?
N'-ethyl-3-methoxy-N'-(4-methylphenyl)benzohydrazide has a molecular weight of 284.36 g/mol, XLogP of 3.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-ethyl-3-methoxy-N'-(4-methylphenyl)benzohydrazide is sourced from PubChem (CID 9181877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).