N'-(2-ethoxybenzoyl)-3,4,5-trimethoxybenzohydrazide

C19H22N2O6 — CID 4926525

IUPACN'-(2-ethoxybenzoyl)-3,4,5-trimethoxybenzohydrazide
SMILESCCOc1ccccc1C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C19H22N2O6/c1-5-27-14-9-7-6-8-13(14)19(23)21-20-18(22)12-10-15(24-2)17(26-4)16(11-12)25-3/h6-11H,5H2,1-4H3,(H,20,22)(H,21,23)
InChIKeyJDUNNCNERBCONR-UHFFFAOYSA-N
MW374.39 g/mol
LogP2.19
Rot. Bonds7

About N'-(2-ethoxybenzoyl)-3,4,5-trimethoxybenzohydrazide

N'-(2-ethoxybenzoyl)-3,4,5-trimethoxybenzohydrazide (PubChem CID 4926525) has the molecular formula C19H22N2O6 and a molecular weight of 374.39 g/mol. Its IUPAC name is N'-(2-ethoxybenzoyl)-3,4,5-trimethoxybenzohydrazide.

Molecular Properties

Compound NameN'-(2-ethoxybenzoyl)-3,4,5-trimethoxybenzohydrazide
PubChem CID4926525
Molecular FormulaC19H22N2O6
Molecular Weight374.39 g/mol
Exact Mass374.15
IUPAC NameN'-(2-ethoxybenzoyl)-3,4,5-trimethoxybenzohydrazide
SMILESCCOc1ccccc1C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1
InChIInChI=1S/C19H22N2O6/c1-5-27-14-9-7-6-8-13(14)19(23)21-20-18(22)12-10-15(24-2)17(26-4)16(11-12)25-3/h6-11H,5H2,1-4H3,(H,20,22)(H,21,23)
InChIKeyJDUNNCNERBCONR-UHFFFAOYSA-N
XLogP2.19
TPSA95.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.39
LogP ≤ 52.19
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

3,4,5-trimethoxy-N'-(2-phenylmethoxybenzoyl)benzohydrazide
CID 4938028
2-propoxy-N-[[(3,4,5-trimethoxybenzoyl)amino]carbamothioyl]benzamide
CID 4949353
N'-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzoyl]-3,4,5-trimethoxybenzohydrazide
CID 25162867
N'-[2-(2-ethoxyphenoxy)acetyl]-2-methoxybenzohydrazide
CID 18159247
N-[2-(benzamidocarbamoyl)phenyl]-3,4,5-trimethoxybenzamide
CID 126008715
N'-(2-chlorobenzoyl)-3,4,5-triethoxybenzohydrazide
CID 7964784
2-ethoxy-N'-[1-(4-methoxyphenyl)ethenyl]benzohydrazide
CID 5052026
2-(3-methylbutoxy)-N-[[(3,4,5-trimethoxybenzoyl)amino]carbamothioyl]benzamide
CID 4944763
N-[4-[[(2-ethoxybenzoyl)amino]carbamoyl]phenyl]benzamide
CID 4926581
3,5-dichloro-N'-(2-methoxybenzoyl)benzohydrazide
CID 17133653
3,4,5-trimethoxy-N-[2-[(2-methoxyphenyl)carbamoyl]phenyl]benzamide
CID 990875
3-chloro-N'-(4-ethoxy-3-methoxybenzoyl)-4,5-dimethoxybenzohydrazide
CID 9439809

Frequently Asked Questions

What is the IUPAC name of N'-(2-ethoxybenzoyl)-3,4,5-trimethoxybenzohydrazide?
The IUPAC name of N'-(2-ethoxybenzoyl)-3,4,5-trimethoxybenzohydrazide (CID 4926525) is N'-(2-ethoxybenzoyl)-3,4,5-trimethoxybenzohydrazide.
What is the SMILES notation for N'-(2-ethoxybenzoyl)-3,4,5-trimethoxybenzohydrazide?
The canonical SMILES for N'-(2-ethoxybenzoyl)-3,4,5-trimethoxybenzohydrazide is CCOc1ccccc1C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1.
What is the InChIKey of N'-(2-ethoxybenzoyl)-3,4,5-trimethoxybenzohydrazide?
The InChIKey is JDUNNCNERBCONR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O6/c1-5-27-14-9-7-6-8-13(14)19(23)21-20-18(22)12-10-15(24-2)17(26-4)16(11-12)25-3/h6-11H,5H2,1-4H3,(H,20,22)(H,21,23).
What are the key properties of N'-(2-ethoxybenzoyl)-3,4,5-trimethoxybenzohydrazide?
N'-(2-ethoxybenzoyl)-3,4,5-trimethoxybenzohydrazide has a molecular weight of 374.39 g/mol, XLogP of 2.19, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-ethoxybenzoyl)-3,4,5-trimethoxybenzohydrazide is sourced from PubChem (CID 4926525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).