2,3-dimethoxy-N'-(2-phenylacetyl)benzohydrazide

C17H18N2O4 — CID 912695

IUPAC2,3-dimethoxy-N'-(2-phenylacetyl)benzohydrazide
SMILESCOc1cccc(C(=O)NNC(=O)Cc2ccccc2)c1OC
InChIInChI=1S/C17H18N2O4/c1-22-14-10-6-9-13(16(14)23-2)17(21)19-18-15(20)11-12-7-4-3-5-8-12/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyJAEORDVBFODKSQ-UHFFFAOYSA-N
MW314.34 g/mol
LogP1.71
Rot. Bonds5

About 2,3-dimethoxy-N'-(2-phenylacetyl)benzohydrazide

2,3-dimethoxy-N'-(2-phenylacetyl)benzohydrazide (PubChem CID 912695) has the molecular formula C17H18N2O4 and a molecular weight of 314.34 g/mol. Its IUPAC name is 2,3-dimethoxy-N'-(2-phenylacetyl)benzohydrazide.

Molecular Properties

Compound Name2,3-dimethoxy-N'-(2-phenylacetyl)benzohydrazide
PubChem CID912695
Molecular FormulaC17H18N2O4
Molecular Weight314.34 g/mol
Exact Mass314.13
IUPAC Name2,3-dimethoxy-N'-(2-phenylacetyl)benzohydrazide
SMILESCOc1cccc(C(=O)NNC(=O)Cc2ccccc2)c1OC
InChIInChI=1S/C17H18N2O4/c1-22-14-10-6-9-13(16(14)23-2)17(21)19-18-15(20)11-12-7-4-3-5-8-12/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyJAEORDVBFODKSQ-UHFFFAOYSA-N
XLogP1.71
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.34
LogP ≤ 51.71
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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Related Compounds

N'-(2-fluorobenzoyl)-2,3-dimethoxybenzohydrazide
CID 921091
2-chloro-N'-[2-(2,3,4-trimethoxyphenyl)acetyl]benzohydrazide
CID 8870426
2,3-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide
CID 27650117
2,3-dimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912335
N-[2-(2,3-dimethoxyphenoxy)ethyl]-2-phenylacetamide
CID 113101933
2-pentoxy-N'-(2-phenylacetyl)benzohydrazide
CID 4946811
N'-(2,3-dimethoxybenzoyl)-3-phenyl-1H-pyrazole-5-carbohydrazide
CID 26823823
2,3-dimethoxy-N-sulfanylbenzamide
CID 71771535
3,4,5-trimethoxy-N'-(2-phenylmethoxybenzoyl)benzohydrazide
CID 4938028
2-phenyl-1-(2,3,4-trimethoxyphenyl)ethanone
CID 14284964
benzyl N-[(2-methoxybenzoyl)amino]carbamate
CID 4935888
N-[(2,3-dimethoxyphenyl)methyl]naphthalene-1-carboxamide
CID 46590604

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethoxy-N'-(2-phenylacetyl)benzohydrazide?
The IUPAC name of 2,3-dimethoxy-N'-(2-phenylacetyl)benzohydrazide (CID 912695) is 2,3-dimethoxy-N'-(2-phenylacetyl)benzohydrazide.
What is the SMILES notation for 2,3-dimethoxy-N'-(2-phenylacetyl)benzohydrazide?
The canonical SMILES for 2,3-dimethoxy-N'-(2-phenylacetyl)benzohydrazide is COc1cccc(C(=O)NNC(=O)Cc2ccccc2)c1OC.
What is the InChIKey of 2,3-dimethoxy-N'-(2-phenylacetyl)benzohydrazide?
The InChIKey is JAEORDVBFODKSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O4/c1-22-14-10-6-9-13(16(14)23-2)17(21)19-18-15(20)11-12-7-4-3-5-8-12/h3-10H,11H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of 2,3-dimethoxy-N'-(2-phenylacetyl)benzohydrazide?
2,3-dimethoxy-N'-(2-phenylacetyl)benzohydrazide has a molecular weight of 314.34 g/mol, XLogP of 1.71, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethoxy-N'-(2-phenylacetyl)benzohydrazide is sourced from PubChem (CID 912695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).