N'-octanoylbenzohydrazide

C15H22N2O2 — CID 4227469

IUPACN'-octanoylbenzohydrazide
SMILESCCCCCCCC(=O)NNC(=O)c1ccccc1
InChIInChI=1S/C15H22N2O2/c1-2-3-4-5-9-12-14(18)16-17-15(19)13-10-7-6-8-11-13/h6-8,10-11H,2-5,9,12H2,1H3,(H,16,18)(H,17,19)
InChIKeyHOMNYQBWHBSLLU-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.81
Rot. Bonds7

About N'-octanoylbenzohydrazide

N'-octanoylbenzohydrazide (PubChem CID 4227469) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N'-octanoylbenzohydrazide.

Molecular Properties

Compound NameN'-octanoylbenzohydrazide
PubChem CID4227469
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN'-octanoylbenzohydrazide
SMILESCCCCCCCC(=O)NNC(=O)c1ccccc1
InChIInChI=1S/C15H22N2O2/c1-2-3-4-5-9-12-14(18)16-17-15(19)13-10-7-6-8-11-13/h6-8,10-11H,2-5,9,12H2,1H3,(H,16,18)(H,17,19)
InChIKeyHOMNYQBWHBSLLU-UHFFFAOYSA-N
XLogP2.81
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-heptanoylbenzohydrazide
CID 4218130
N'-nonanoylbenzohydrazide
CID 5163159
1-N',3-N'-di(dodecanoyl)benzene-1,3-dicarbohydrazide
CID 3092349
4-methyl-N'-octanoylbenzohydrazide
CID 4958769
N'-tetradecanoylpyridine-4-carbohydrazide
CID 54792198
3-methyl-N'-octanoylbenzohydrazide
CID 2218282
N'-dodecanoyl-4-heptylbenzohydrazide
CID 3103832
N'-decanoylpyridine-3-carbohydrazide
CID 132992060
N'-dodecanoylpyridine-3-carbohydrazide
CID 171977470
N-[4-[(octanoylamino)carbamoyl]phenyl]pentanamide
CID 4958829
N'-heptanoyl-4-hexoxybenzohydrazide
CID 54789289
N-[4-[2-(4-hexoxybenzoyl)hydrazinyl]-4-oxobutyl]benzamide
CID 29264757

Frequently Asked Questions

What is the IUPAC name of N'-octanoylbenzohydrazide?
The IUPAC name of N'-octanoylbenzohydrazide (CID 4227469) is N'-octanoylbenzohydrazide.
What is the SMILES notation for N'-octanoylbenzohydrazide?
The canonical SMILES for N'-octanoylbenzohydrazide is CCCCCCCC(=O)NNC(=O)c1ccccc1.
What is the InChIKey of N'-octanoylbenzohydrazide?
The InChIKey is HOMNYQBWHBSLLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-2-3-4-5-9-12-14(18)16-17-15(19)13-10-7-6-8-11-13/h6-8,10-11H,2-5,9,12H2,1H3,(H,16,18)(H,17,19).
What are the key properties of N'-octanoylbenzohydrazide?
N'-octanoylbenzohydrazide has a molecular weight of 262.35 g/mol, XLogP of 2.81, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-octanoylbenzohydrazide is sourced from PubChem (CID 4227469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).