N'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide

C16H17N3O3 — CID 18147998

IUPACN'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide
SMILESCCOc1ccc(C(=O)NNC(=O)c2ccc(C)nc2)cc1
InChIInChI=1S/C16H17N3O3/c1-3-22-14-8-6-12(7-9-14)15(20)18-19-16(21)13-5-4-11(2)17-10-13/h4-10H,3H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyIWDUCTSJGJKZRI-UHFFFAOYSA-N
MW299.33 g/mol
LogP1.86
Rot. Bonds4

About N'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide

N'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide (PubChem CID 18147998) has the molecular formula C16H17N3O3 and a molecular weight of 299.33 g/mol. Its IUPAC name is N'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide.

Molecular Properties

Compound NameN'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide
PubChem CID18147998
Molecular FormulaC16H17N3O3
Molecular Weight299.33 g/mol
Exact Mass299.13
IUPAC NameN'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide
SMILESCCOc1ccc(C(=O)NNC(=O)c2ccc(C)nc2)cc1
InChIInChI=1S/C16H17N3O3/c1-3-22-14-8-6-12(7-9-14)15(20)18-19-16(21)13-5-4-11(2)17-10-13/h4-10H,3H2,1-2H3,(H,18,20)(H,19,21)
InChIKeyIWDUCTSJGJKZRI-UHFFFAOYSA-N
XLogP1.86
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 51.86
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

4-ethoxy-N-[4-[[(6-methylpyridine-3-carbonyl)amino]carbamoyl]phenyl]benzenesulfonamide
CID 30291015
6-(dimethylamino)-N'-(4-ethoxybenzoyl)pyridine-3-carbohydrazide
CID 35701839
N'-(4-ethoxybenzoyl)pyridine-4-carbohydrazide
CID 959949
N'-(4-butoxybenzoyl)-4-ethoxybenzohydrazide
CID 7979581
N'-[4-(diethylamino)benzoyl]-6-methylpyridine-3-carbohydrazide
CID 30288485
N-[(1S)-1-(4-ethoxyphenyl)-2-methoxyethyl]-6-methylpyridine-3-carboxamide
CID 124730066
ethyl 4-[2-(4-ethoxybenzoyl)hydrazinyl]-4-oxobutanoate
CID 9086442
N'-(4-ethoxybenzoyl)-2,4-dimethylbenzohydrazide
CID 7600016
[2-(4-ethoxyanilino)-2-oxoethyl] 6-methylpyridine-3-carboxylate
CID 71823503
N'-(4-ethoxybenzoyl)-4-(methylsulfanylmethyl)benzohydrazide
CID 7979451
4-ethoxy-N'-pyrimidin-2-ylbenzohydrazide
CID 47140397
N'-(4-ethoxybenzoyl)-4-(5-methylpyrazol-1-yl)benzohydrazide
CID 9327686

Frequently Asked Questions

What is the IUPAC name of N'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide?
The IUPAC name of N'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide (CID 18147998) is N'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide.
What is the SMILES notation for N'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide?
The canonical SMILES for N'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide is CCOc1ccc(C(=O)NNC(=O)c2ccc(C)nc2)cc1.
What is the InChIKey of N'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide?
The InChIKey is IWDUCTSJGJKZRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3/c1-3-22-14-8-6-12(7-9-14)15(20)18-19-16(21)13-5-4-11(2)17-10-13/h4-10H,3H2,1-2H3,(H,18,20)(H,19,21).
What are the key properties of N'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide?
N'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide has a molecular weight of 299.33 g/mol, XLogP of 1.86, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-ethoxybenzoyl)-6-methylpyridine-3-carbohydrazide is sourced from PubChem (CID 18147998), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).