N'-(4-fluorobenzoyl)-2-(2-methoxyethoxy)benzohydrazide

C17H17FN2O4 — CID 86827465

IUPACN'-(4-fluorobenzoyl)-2-(2-methoxyethoxy)benzohydrazide
SMILESCOCCOc1ccccc1C(=O)NNC(=O)c1ccc(F)cc1
InChIInChI=1S/C17H17FN2O4/c1-23-10-11-24-15-5-3-2-4-14(15)17(22)20-19-16(21)12-6-8-13(18)9-7-12/h2-9H,10-11H2,1H3,(H,19,21)(H,20,22)
InChIKeyNRYCIUOJGNOWCZ-UHFFFAOYSA-N
MW332.33 g/mol
LogP1.93
Rot. Bonds6

About N'-(4-fluorobenzoyl)-2-(2-methoxyethoxy)benzohydrazide

N'-(4-fluorobenzoyl)-2-(2-methoxyethoxy)benzohydrazide (PubChem CID 86827465) has the molecular formula C17H17FN2O4 and a molecular weight of 332.33 g/mol. Its IUPAC name is N'-(4-fluorobenzoyl)-2-(2-methoxyethoxy)benzohydrazide.

Molecular Properties

Compound NameN'-(4-fluorobenzoyl)-2-(2-methoxyethoxy)benzohydrazide
PubChem CID86827465
Molecular FormulaC17H17FN2O4
Molecular Weight332.33 g/mol
Exact Mass332.12
IUPAC NameN'-(4-fluorobenzoyl)-2-(2-methoxyethoxy)benzohydrazide
SMILESCOCCOc1ccccc1C(=O)NNC(=O)c1ccc(F)cc1
InChIInChI=1S/C17H17FN2O4/c1-23-10-11-24-15-5-3-2-4-14(15)17(22)20-19-16(21)12-6-8-13(18)9-7-12/h2-9H,10-11H2,1H3,(H,19,21)(H,20,22)
InChIKeyNRYCIUOJGNOWCZ-UHFFFAOYSA-N
XLogP1.93
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.33
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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'-[4-(2-methoxyethoxy)benzoyl]-2-phenylmethoxybenzohydrazide
CID 17353669
2-methoxy-N'-[4-(2-phenoxyethoxy)benzoyl]benzohydrazide
CID 4952919
N'-(4-chlorobenzoyl)-2-propoxybenzohydrazide
CID 4931565
2-propoxy-N'-(2-propoxybenzoyl)benzohydrazide
CID 4948435
N'-(2-ethoxyacetyl)-2-(2-methoxyethoxy)benzohydrazide
CID 17140943
N'-benzoyl-2-(3-methylbutoxy)benzohydrazide
CID 4944041
N-methoxy-2-(2-methoxyethoxy)benzamide
CID 47366431
2-chloro-N'-[4-(2-methoxyethoxy)benzoyl]benzohydrazide
CID 17353590
N'-benzoyl-5-bromo-2-(2-methoxyethoxy)benzohydrazide
CID 17357395
N-[[(3,4-dimethoxybenzoyl)amino]carbamothioyl]-2-(2-methoxyethoxy)benzamide
CID 17356225
N-[4-[[[2-(2-ethoxyethoxy)benzoyl]amino]carbamoyl]phenyl]propanamide
CID 17122839
N'-(4-fluorobenzoyl)-4-(methoxymethyl)benzohydrazide
CID 8573769

Frequently Asked Questions

What is the IUPAC name of N'-(4-fluorobenzoyl)-2-(2-methoxyethoxy)benzohydrazide?
The IUPAC name of N'-(4-fluorobenzoyl)-2-(2-methoxyethoxy)benzohydrazide (CID 86827465) is N'-(4-fluorobenzoyl)-2-(2-methoxyethoxy)benzohydrazide.
What is the SMILES notation for N'-(4-fluorobenzoyl)-2-(2-methoxyethoxy)benzohydrazide?
The canonical SMILES for N'-(4-fluorobenzoyl)-2-(2-methoxyethoxy)benzohydrazide is COCCOc1ccccc1C(=O)NNC(=O)c1ccc(F)cc1.
What is the InChIKey of N'-(4-fluorobenzoyl)-2-(2-methoxyethoxy)benzohydrazide?
The InChIKey is NRYCIUOJGNOWCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN2O4/c1-23-10-11-24-15-5-3-2-4-14(15)17(22)20-19-16(21)12-6-8-13(18)9-7-12/h2-9H,10-11H2,1H3,(H,19,21)(H,20,22).
What are the key properties of N'-(4-fluorobenzoyl)-2-(2-methoxyethoxy)benzohydrazide?
N'-(4-fluorobenzoyl)-2-(2-methoxyethoxy)benzohydrazide has a molecular weight of 332.33 g/mol, XLogP of 1.93, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-fluorobenzoyl)-2-(2-methoxyethoxy)benzohydrazide is sourced from PubChem (CID 86827465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).