N-(2-hydroxybenzoyl)-2-(4-methylphenoxy)pyridine-3-carbohydrazide

C20H17N3O4 — CID 91328730

IUPACN-(2-hydroxybenzoyl)-2-(4-methylphenoxy)pyridine-3-carbohydrazide
SMILESCc1ccc(Oc2ncccc2C(=O)N(N)C(=O)c2ccccc2O)cc1
InChIInChI=1S/C20H17N3O4/c1-13-8-10-14(11-9-13)27-18-16(6-4-12-22-18)20(26)23(21)19(25)15-5-2-3-7-17(15)24/h2-12,24H,21H2,1H3
InChIKeyNUHKGLMJXVNZNB-UHFFFAOYSA-N
MW363.37 g/mol
LogP3.04
Rot. Bonds4

About N-(2-hydroxybenzoyl)-2-(4-methylphenoxy)pyridine-3-carbohydrazide

N-(2-hydroxybenzoyl)-2-(4-methylphenoxy)pyridine-3-carbohydrazide (PubChem CID 91328730) has the molecular formula C20H17N3O4 and a molecular weight of 363.37 g/mol. Its IUPAC name is N-(2-hydroxybenzoyl)-2-(4-methylphenoxy)pyridine-3-carbohydrazide.

Molecular Properties

Compound NameN-(2-hydroxybenzoyl)-2-(4-methylphenoxy)pyridine-3-carbohydrazide
PubChem CID91328730
Molecular FormulaC20H17N3O4
Molecular Weight363.37 g/mol
Exact Mass363.12
IUPAC NameN-(2-hydroxybenzoyl)-2-(4-methylphenoxy)pyridine-3-carbohydrazide
SMILESCc1ccc(Oc2ncccc2C(=O)N(N)C(=O)c2ccccc2O)cc1
InChIInChI=1S/C20H17N3O4/c1-13-8-10-14(11-9-13)27-18-16(6-4-12-22-18)20(26)23(21)19(25)15-5-2-3-7-17(15)24/h2-12,24H,21H2,1H3
InChIKeyNUHKGLMJXVNZNB-UHFFFAOYSA-N
XLogP3.04
TPSA105.75 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.37
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-(4-methylphenoxy)pyridine-3-carbonyl chloride
CID 2774899
[2-(4-methylphenoxy)-3-pyridinyl]-pyrrolidin-1-ylmethanone
CID 101054143
N,N-diethyl-2-(4-methoxyphenoxy)pyridine-3-carboxamide
CID 23767035
N'-(4-methylphenyl)-2-phenoxypyridine-3-carbohydrazide
CID 2812497
N-methyl-N-[2-(3-methylphenoxy)ethyl]-2-phenoxypyridine-3-carboxamide
CID 55431158
(2-methoxy-5-methylphenyl)methyl 2-phenoxypyridine-3-carboxylate
CID 18197147
2-(4-chlorophenoxy)pyridine-3-carboxamide
CID 2774902
2-[4-(methylamino)phenoxy]pyridine-3-carboxamide
CID 54909137
2-(4-ethylphenoxy)pyridine-3-carboxamide
CID 91385199
N-(3-amino-2,2-dimethylpropyl)-2-(4-bromophenoxy)-N-methylpyridine-3-carboxamide
CID 119653810
2-(4-fluorophenoxy)pyridine-3-carboxylic acid
CID 605123
2-(4-chlorophenoxy)pyridine-3-carboxylic acid
CID 609454

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxybenzoyl)-2-(4-methylphenoxy)pyridine-3-carbohydrazide?
The IUPAC name of N-(2-hydroxybenzoyl)-2-(4-methylphenoxy)pyridine-3-carbohydrazide (CID 91328730) is N-(2-hydroxybenzoyl)-2-(4-methylphenoxy)pyridine-3-carbohydrazide.
What is the SMILES notation for N-(2-hydroxybenzoyl)-2-(4-methylphenoxy)pyridine-3-carbohydrazide?
The canonical SMILES for N-(2-hydroxybenzoyl)-2-(4-methylphenoxy)pyridine-3-carbohydrazide is Cc1ccc(Oc2ncccc2C(=O)N(N)C(=O)c2ccccc2O)cc1.
What is the InChIKey of N-(2-hydroxybenzoyl)-2-(4-methylphenoxy)pyridine-3-carbohydrazide?
The InChIKey is NUHKGLMJXVNZNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O4/c1-13-8-10-14(11-9-13)27-18-16(6-4-12-22-18)20(26)23(21)19(25)15-5-2-3-7-17(15)24/h2-12,24H,21H2,1H3.
What are the key properties of N-(2-hydroxybenzoyl)-2-(4-methylphenoxy)pyridine-3-carbohydrazide?
N-(2-hydroxybenzoyl)-2-(4-methylphenoxy)pyridine-3-carbohydrazide has a molecular weight of 363.37 g/mol, XLogP of 3.04, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxybenzoyl)-2-(4-methylphenoxy)pyridine-3-carbohydrazide is sourced from PubChem (CID 91328730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).