N'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide

C15H15N3O3 — CID 839627

IUPACN'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide
SMILESCc1ccc(OCC(=O)NNC(=O)c2cccnc2)cc1
InChIInChI=1S/C15H15N3O3/c1-11-4-6-13(7-5-11)21-10-14(19)17-18-15(20)12-3-2-8-16-9-12/h2-9H,10H2,1H3,(H,17,19)(H,18,20)
InChIKeyOCKOIKRAMXJLPP-UHFFFAOYSA-N
MW285.30 g/mol
LogP1.23
Rot. Bonds4

About N'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide

N'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide (PubChem CID 839627) has the molecular formula C15H15N3O3 and a molecular weight of 285.30 g/mol. Its IUPAC name is N'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide.

Molecular Properties

Compound NameN'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide
PubChem CID839627
Molecular FormulaC15H15N3O3
Molecular Weight285.30 g/mol
Exact Mass285.11
IUPAC NameN'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide
SMILESCc1ccc(OCC(=O)NNC(=O)c2cccnc2)cc1
InChIInChI=1S/C15H15N3O3/c1-11-4-6-13(7-5-11)21-10-14(19)17-18-15(20)12-3-2-8-16-9-12/h2-9H,10H2,1H3,(H,17,19)(H,18,20)
InChIKeyOCKOIKRAMXJLPP-UHFFFAOYSA-N
XLogP1.23
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.30
LogP ≤ 51.23
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

N'-[2-(3-methoxyphenoxy)acetyl]pyridine-3-carbohydrazide
CID 17386186
N-[2-[[2-(4-ethoxyphenoxy)acetyl]amino]ethyl]pyridine-3-carboxamide
CID 39577143
3-butan-2-yloxy-N'-[2-(4-methylphenoxy)acetyl]benzohydrazide
CID 17149890
N-[3-[[2-(4-ethoxyphenoxy)acetyl]amino]propyl]pyridine-3-carboxamide
CID 108926648
1-(4-ethoxyphenyl)-3-(pyridine-3-carbonylamino)urea
CID 972166
N'-[5-amino-6-[2-(2-phenoxyacetyl)hydrazinyl]pyrimidin-4-yl]pyridine-3-carbohydrazide
CID 19151895
N'-[2-(2-methylphenyl)acetyl]pyridine-3-carbohydrazide
CID 35152193
N'-[2-(4-methylphenoxy)acetyl]-4-prop-2-enoxybenzohydrazide
CID 4925883
N'-[2-(6,7,8,9-tetrahydrodibenzofuran-2-yloxy)acetyl]pyridine-3-carbohydrazide
CID 35015838
N'-[3-[(3-methylphenyl)methoxy]benzoyl]pyridine-3-carbohydrazide
CID 35153545
3-methyl-N'-[2-(3-methylphenoxy)acetyl]benzohydrazide
CID 732321
4-methyl-N'-(2-naphthalen-2-yloxyacetyl)benzohydrazide
CID 809232

Frequently Asked Questions

What is the IUPAC name of N'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide?
The IUPAC name of N'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide (CID 839627) is N'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide.
What is the SMILES notation for N'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide?
The canonical SMILES for N'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide is Cc1ccc(OCC(=O)NNC(=O)c2cccnc2)cc1.
What is the InChIKey of N'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide?
The InChIKey is OCKOIKRAMXJLPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O3/c1-11-4-6-13(7-5-11)21-10-14(19)17-18-15(20)12-3-2-8-16-9-12/h2-9H,10H2,1H3,(H,17,19)(H,18,20).
What are the key properties of N'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide?
N'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide has a molecular weight of 285.30 g/mol, XLogP of 1.23, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(4-methylphenoxy)acetyl]pyridine-3-carbohydrazide is sourced from PubChem (CID 839627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).