N'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide

C22H21N3O5 — CID 55996835

IUPACN'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)c2ccnc(OCc3ccccc3)c2)cc1OC
InChIInChI=1S/C22H21N3O5/c1-28-18-9-8-16(12-19(18)29-2)21(26)24-25-22(27)17-10-11-23-20(13-17)30-14-15-6-4-3-5-7-15/h3-13H,14H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyUTAWJCMPUYEMHM-UHFFFAOYSA-N
MW407.43 g/mol
LogP2.75
Rot. Bonds7

About N'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide

N'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide (PubChem CID 55996835) has the molecular formula C22H21N3O5 and a molecular weight of 407.43 g/mol. Its IUPAC name is N'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide.

Molecular Properties

Compound NameN'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide
PubChem CID55996835
Molecular FormulaC22H21N3O5
Molecular Weight407.43 g/mol
Exact Mass407.15
IUPAC NameN'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide
SMILESCOc1ccc(C(=O)NNC(=O)c2ccnc(OCc3ccccc3)c2)cc1OC
InChIInChI=1S/C22H21N3O5/c1-28-18-9-8-16(12-19(18)29-2)21(26)24-25-22(27)17-10-11-23-20(13-17)30-14-15-6-4-3-5-7-15/h3-13H,14H2,1-2H3,(H,24,26)(H,25,27)
InChIKeyUTAWJCMPUYEMHM-UHFFFAOYSA-N
XLogP2.75
TPSA98.78 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500407.43
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methoxy-2-phenylmethoxypyridine-4-carboxamide
CID 47366546
N-ethyl-2-phenylmethoxypyridine-4-carboxamide
CID 47366269
4-methoxy-N-methyl-3-phenylmethoxybenzamide
CID 138553454
3,4-dimethoxy-N'-(3-phenylpropanoyl)benzohydrazide
CID 1107941
N'-(4-ethoxybenzoyl)-3-methoxy-4-phenylmethoxybenzohydrazide
CID 9492724
N'-(3-methoxy-4-phenylmethoxybenzoyl)-2-methylfuran-3-carbohydrazide
CID 9472683
3-methoxy-N-phenyl-4-phenylmethoxybenzamide
CID 5161412
methyl 1-[(2-phenylmethoxypyridine-4-carbonyl)amino]cyclopentane-1-carboxylate
CID 86834370
N'-[2-(2,4-dimethylanilino)acetyl]-2-phenylmethoxypyridine-4-carbohydrazide
CID 56503764
2-phenylmethoxy-N-(2-phenylphenyl)pyridine-4-carboxamide
CID 60566988
N-[[2-(hydroxymethyl)phenyl]methyl]-2-phenylmethoxypyridine-4-carboxamide
CID 110908784
4-methoxy-N-[(2-phenylmethoxy-4-pyridinyl)methyl]-3-(propan-2-ylsulfamoyl)benzamide
CID 46466460

Frequently Asked Questions

What is the IUPAC name of N'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide?
The IUPAC name of N'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide (CID 55996835) is N'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide.
What is the SMILES notation for N'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide?
The canonical SMILES for N'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide is COc1ccc(C(=O)NNC(=O)c2ccnc(OCc3ccccc3)c2)cc1OC.
What is the InChIKey of N'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide?
The InChIKey is UTAWJCMPUYEMHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O5/c1-28-18-9-8-16(12-19(18)29-2)21(26)24-25-22(27)17-10-11-23-20(13-17)30-14-15-6-4-3-5-7-15/h3-13H,14H2,1-2H3,(H,24,26)(H,25,27).
What are the key properties of N'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide?
N'-(3,4-dimethoxybenzoyl)-2-phenylmethoxypyridine-4-carbohydrazide has a molecular weight of 407.43 g/mol, XLogP of 2.75, 7 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-phenylmethoxypyridine-4-carbohydrazide is sourced from PubChem (CID 55996835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).