N'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide

C18H20N2O6 — CID 1210380

IUPACN'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)c2c(OC)cccc2OC)cc1OC
InChIInChI=1S/C18H20N2O6/c1-23-12-9-8-11(10-15(12)26-4)17(21)19-20-18(22)16-13(24-2)6-5-7-14(16)25-3/h5-10H,1-4H3,(H,19,21)(H,20,22)
InChIKeyRFYFTSLDEMKJTP-UHFFFAOYSA-N
MW360.37 g/mol
LogP1.80
Rot. Bonds6

About N'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide

N'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide (PubChem CID 1210380) has the molecular formula C18H20N2O6 and a molecular weight of 360.37 g/mol. Its IUPAC name is N'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide.

Molecular Properties

Compound NameN'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide
PubChem CID1210380
Molecular FormulaC18H20N2O6
Molecular Weight360.37 g/mol
Exact Mass360.13
IUPAC NameN'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)c2c(OC)cccc2OC)cc1OC
InChIInChI=1S/C18H20N2O6/c1-23-12-9-8-11(10-15(12)26-4)17(21)19-20-18(22)16-13(24-2)6-5-7-14(16)25-3/h5-10H,1-4H3,(H,19,21)(H,20,22)
InChIKeyRFYFTSLDEMKJTP-UHFFFAOYSA-N
XLogP1.80
TPSA95.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.37
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2,6-dichloro-N'-(3,4-dimethoxybenzoyl)benzohydrazide
CID 78770574
methyl 3-[[(3,4-dimethoxybenzoyl)amino]carbamoyl]benzoate
CID 17175462
3,4-dimethoxy-N'-[2-(2-methoxyphenyl)acetyl]benzohydrazide
CID 24645288
N'-(2,2-dimethylpropanoyl)-3,4-dimethoxybenzohydrazide
CID 873947
3,4-dimethoxy-N'-propanoylbenzohydrazide
CID 785401
N'-(3,5-difluorobenzoyl)-3,4-dimethoxybenzohydrazide
CID 24645355
N'-(2,4-difluorobenzoyl)-3,4-dimethoxybenzohydrazide
CID 26893672
N'-[2-(2,6-dichlorophenyl)acetyl]-3,4-dimethoxybenzohydrazide
CID 35934045
3,4-dimethoxy-N'-[3-(pyrimidin-2-ylamino)benzoyl]benzohydrazide
CID 31890706
3,4-dimethoxy-N-sulfanylbenzamide
CID 71771275
N'-(5-bromo-2-methoxybenzoyl)-3,4-dimethoxybenzohydrazide
CID 17094413
N'-(9H-fluoren-9-yl)-3,4-dimethoxybenzohydrazide
CID 26619016

Frequently Asked Questions

What is the IUPAC name of N'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide?
The IUPAC name of N'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide (CID 1210380) is N'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide.
What is the SMILES notation for N'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide?
The canonical SMILES for N'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide is COc1ccc(C(=O)NNC(=O)c2c(OC)cccc2OC)cc1OC.
What is the InChIKey of N'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide?
The InChIKey is RFYFTSLDEMKJTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O6/c1-23-12-9-8-11(10-15(12)26-4)17(21)19-20-18(22)16-13(24-2)6-5-7-14(16)25-3/h5-10H,1-4H3,(H,19,21)(H,20,22).
What are the key properties of N'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide?
N'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide has a molecular weight of 360.37 g/mol, XLogP of 1.80, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3,4-dimethoxybenzoyl)-2,6-dimethoxybenzohydrazide is sourced from PubChem (CID 1210380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).