4-[(6-methyl-2-nitro-3-pyridinyl)oxy]pentanehydrazide

C11H16N4O4 — CID 63569304

IUPAC4-[(6-methyl-2-nitro-3-pyridinyl)oxy]pentanehydrazide
SMILESCc1ccc(OC(C)CCC(=O)NN)c([N+](=O)[O-])n1
InChIInChI=1S/C11H16N4O4/c1-7-3-5-9(11(13-7)15(17)18)19-8(2)4-6-10(16)14-12/h3,5,8H,4,6,12H2,1-2H3,(H,14,16)
InChIKeyTZFKMHVDJWTQMV-UHFFFAOYSA-N
MW268.27 g/mol
LogP0.84
Rot. Bonds6

About 4-[(6-methyl-2-nitro-3-pyridinyl)oxy]pentanehydrazide

4-[(6-methyl-2-nitro-3-pyridinyl)oxy]pentanehydrazide (PubChem CID 63569304) has the molecular formula C11H16N4O4 and a molecular weight of 268.27 g/mol. Its IUPAC name is 4-[(6-methyl-2-nitro-3-pyridinyl)oxy]pentanehydrazide.

Molecular Properties

Compound Name4-[(6-methyl-2-nitro-3-pyridinyl)oxy]pentanehydrazide
PubChem CID63569304
Molecular FormulaC11H16N4O4
Molecular Weight268.27 g/mol
Exact Mass268.12
IUPAC Name4-[(6-methyl-2-nitro-3-pyridinyl)oxy]pentanehydrazide
SMILESCc1ccc(OC(C)CCC(=O)NN)c([N+](=O)[O-])n1
InChIInChI=1S/C11H16N4O4/c1-7-3-5-9(11(13-7)15(17)18)19-8(2)4-6-10(16)14-12/h3,5,8H,4,6,12H2,1-2H3,(H,14,16)
InChIKeyTZFKMHVDJWTQMV-UHFFFAOYSA-N
XLogP0.84
TPSA120.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 50.84
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': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 4-[(6-methyl-2-nitro-3-pyridinyl)oxy]pentanehydrazide 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

2-[(6-methyl-2-nitro-3-pyridinyl)oxy]butanehydrazide
CID 55214576
2-[(6-methyl-2-nitro-3-pyridinyl)oxy]-N-pentan-2-ylacetamide
CID 3882767
2-[(6-methyl-2-nitro-3-pyridinyl)oxy]-N-(2-methylpropyl)acetamide
CID 4007812
N-(4-chlorophenyl)-2-[(6-methyl-2-nitro-3-pyridinyl)oxy]propanamide
CID 4818098
N-cyclohexyl-2-[(6-methyl-2-nitro-3-pyridinyl)oxy]propanamide
CID 4817886
4-(2-bromo-4-chlorophenoxy)pentanehydrazide
CID 63575506
N-[2-[(6-methyl-2-nitro-3-pyridinyl)oxy]ethyl]propan-1-amine
CID 62098823
4-(4-methylsulfonylphenoxy)pentanehydrazide
CID 63569111
butyl 2-[(6-methyl-2-nitro-3-pyridinyl)oxy]acetate
CID 60626235
4-(4-methyl-2-nitrophenoxy)pentanoic acid
CID 62212721
N-(3-cyanophenyl)-2-[(6-methyl-2-nitro-3-pyridinyl)oxy]propanamide
CID 4964242
N-[4-(dimethylamino)phenyl]-2-[(6-methyl-2-nitro-3-pyridinyl)oxy]acetamide
CID 3969167

Frequently Asked Questions

What is the IUPAC name of 4-[(6-methyl-2-nitro-3-pyridinyl)oxy]pentanehydrazide?
The IUPAC name of 4-[(6-methyl-2-nitro-3-pyridinyl)oxy]pentanehydrazide (CID 63569304) is 4-[(6-methyl-2-nitro-3-pyridinyl)oxy]pentanehydrazide.
What is the SMILES notation for 4-[(6-methyl-2-nitro-3-pyridinyl)oxy]pentanehydrazide?
The canonical SMILES for 4-[(6-methyl-2-nitro-3-pyridinyl)oxy]pentanehydrazide is Cc1ccc(OC(C)CCC(=O)NN)c([N+](=O)[O-])n1.
What is the InChIKey of 4-[(6-methyl-2-nitro-3-pyridinyl)oxy]pentanehydrazide?
The InChIKey is TZFKMHVDJWTQMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O4/c1-7-3-5-9(11(13-7)15(17)18)19-8(2)4-6-10(16)14-12/h3,5,8H,4,6,12H2,1-2H3,(H,14,16).
What are the key properties of 4-[(6-methyl-2-nitro-3-pyridinyl)oxy]pentanehydrazide?
4-[(6-methyl-2-nitro-3-pyridinyl)oxy]pentanehydrazide has a molecular weight of 268.27 g/mol, XLogP of 0.84, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-methyl-2-nitro-3-pyridinyl)oxy]pentanehydrazide is sourced from PubChem (CID 63569304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).