N'-butanoyl-4-butoxybenzohydrazide

C15H22N2O3 — CID 17340318

IUPACN'-butanoyl-4-butoxybenzohydrazide
SMILESCCCCOc1ccc(C(=O)NNC(=O)CCC)cc1
InChIInChI=1S/C15H22N2O3/c1-3-5-11-20-13-9-7-12(8-10-13)15(19)17-16-14(18)6-4-2/h7-10H,3-6,11H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyFLJDPDLOYHMCOW-UHFFFAOYSA-N
MW278.35 g/mol
LogP2.43
Rot. Bonds7

About N'-butanoyl-4-butoxybenzohydrazide

N'-butanoyl-4-butoxybenzohydrazide (PubChem CID 17340318) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is N'-butanoyl-4-butoxybenzohydrazide.

Molecular Properties

Compound NameN'-butanoyl-4-butoxybenzohydrazide
PubChem CID17340318
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC NameN'-butanoyl-4-butoxybenzohydrazide
SMILESCCCCOc1ccc(C(=O)NNC(=O)CCC)cc1
InChIInChI=1S/C15H22N2O3/c1-3-5-11-20-13-9-7-12(8-10-13)15(19)17-16-14(18)6-4-2/h7-10H,3-6,11H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyFLJDPDLOYHMCOW-UHFFFAOYSA-N
XLogP2.43
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N'-butanoyl-4-butoxybenzohydrazide 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

N'-heptanoyl-4-hexoxybenzohydrazide
CID 54789289
N'-butanoyl-4-(2-phenoxyethoxy)benzohydrazide
CID 17340326
N'-butanoyl-4-(3-methylbutoxy)benzohydrazide
CID 4927928
N'-(4-butoxybenzoyl)-4-ethoxybenzohydrazide
CID 7979581
N'-heptanoyl-4-(3-methylbutoxy)benzohydrazide
CID 54789257
N-[4-[[(4-propoxybenzoyl)amino]carbamoyl]phenyl]butanamide
CID 4938631
4-hexoxy-N'-(4-oxo-4-phenylbutanoyl)benzohydrazide
CID 46423810
4-butoxy-N'-[2-(4-methoxyphenyl)acetyl]benzohydrazide
CID 4936338
4-pentoxy-N'-(2-phenoxyacetyl)benzohydrazide
CID 4935241
4-ethoxy-N'-[4-(4-methoxyphenoxy)butanoyl]benzohydrazide
CID 9492733
4-(4-docosoxyphenyl)-N'-[4-(4-docosoxyphenyl)benzoyl]benzohydrazide
CID 102344080
[2-[2-(4-hexoxybenzoyl)hydrazinyl]-2-oxoethyl]urea
CID 94496970

Frequently Asked Questions

What is the IUPAC name of N'-butanoyl-4-butoxybenzohydrazide?
The IUPAC name of N'-butanoyl-4-butoxybenzohydrazide (CID 17340318) is N'-butanoyl-4-butoxybenzohydrazide.
What is the SMILES notation for N'-butanoyl-4-butoxybenzohydrazide?
The canonical SMILES for N'-butanoyl-4-butoxybenzohydrazide is CCCCOc1ccc(C(=O)NNC(=O)CCC)cc1.
What is the InChIKey of N'-butanoyl-4-butoxybenzohydrazide?
The InChIKey is FLJDPDLOYHMCOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-3-5-11-20-13-9-7-12(8-10-13)15(19)17-16-14(18)6-4-2/h7-10H,3-6,11H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of N'-butanoyl-4-butoxybenzohydrazide?
N'-butanoyl-4-butoxybenzohydrazide has a molecular weight of 278.35 g/mol, XLogP of 2.43, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-butanoyl-4-butoxybenzohydrazide is sourced from PubChem (CID 17340318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).