2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide

C17H18N2O4 — CID 793888

IUPAC2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)c2ccccc2C)c(OC)c1
InChIInChI=1S/C17H18N2O4/c1-11-6-4-5-7-13(11)16(20)18-19-17(21)14-9-8-12(22-2)10-15(14)23-3/h4-10H,1-3H3,(H,18,20)(H,19,21)
InChIKeyOBUYOGLLJMHQED-UHFFFAOYSA-N
MW314.34 g/mol
LogP2.09
Rot. Bonds4

About 2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide

2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide (PubChem CID 793888) has the molecular formula C17H18N2O4 and a molecular weight of 314.34 g/mol. Its IUPAC name is 2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide.

Molecular Properties

Compound Name2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide
PubChem CID793888
Molecular FormulaC17H18N2O4
Molecular Weight314.34 g/mol
Exact Mass314.13
IUPAC Name2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)c2ccccc2C)c(OC)c1
InChIInChI=1S/C17H18N2O4/c1-11-6-4-5-7-13(11)16(20)18-19-17(21)14-9-8-12(22-2)10-15(14)23-3/h4-10H,1-3H3,(H,18,20)(H,19,21)
InChIKeyOBUYOGLLJMHQED-UHFFFAOYSA-N
XLogP2.09
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide?
The IUPAC name of 2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide (CID 793888) is 2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide.
What is the SMILES notation for 2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide?
The canonical SMILES for 2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide is COc1ccc(C(=O)NNC(=O)c2ccccc2C)c(OC)c1.
What is the InChIKey of 2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide?
The InChIKey is OBUYOGLLJMHQED-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4/c1-11-6-4-5-7-13(11)16(20)18-19-17(21)14-9-8-12(22-2)10-15(14)23-3/h4-10H,1-3H3,(H,18,20)(H,19,21).
What are the key properties of 2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide?
2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide has a molecular weight of 314.34 g/mol, XLogP of 2.09, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-N'-(2-methylbenzoyl)benzohydrazide is sourced from PubChem (CID 793888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).