N'-(2,6-difluorophenyl)-4-ethoxybenzohydrazide

C15H14F2N2O2 — CID 127034362

IUPACN'-(2,6-difluorophenyl)-4-ethoxybenzohydrazide
SMILESCCOc1ccc(C(=O)NNc2c(F)cccc2F)cc1
InChIInChI=1S/C15H14F2N2O2/c1-2-21-11-8-6-10(7-9-11)15(20)19-18-14-12(16)4-3-5-13(14)17/h3-9,18H,2H2,1H3,(H,19,20)
InChIKeyBTJGUJTZSFQHTM-UHFFFAOYSA-N
MW292.29 g/mol
LogP3.12
Rot. Bonds5

About N'-(2,6-difluorophenyl)-4-ethoxybenzohydrazide

N'-(2,6-difluorophenyl)-4-ethoxybenzohydrazide (PubChem CID 127034362) has the molecular formula C15H14F2N2O2 and a molecular weight of 292.29 g/mol. Its IUPAC name is N'-(2,6-difluorophenyl)-4-ethoxybenzohydrazide.

Molecular Properties

Compound NameN'-(2,6-difluorophenyl)-4-ethoxybenzohydrazide
PubChem CID127034362
Molecular FormulaC15H14F2N2O2
Molecular Weight292.29 g/mol
Exact Mass292.10
IUPAC NameN'-(2,6-difluorophenyl)-4-ethoxybenzohydrazide
SMILESCCOc1ccc(C(=O)NNc2c(F)cccc2F)cc1
InChIInChI=1S/C15H14F2N2O2/c1-2-21-11-8-6-10(7-9-11)15(20)19-18-14-12(16)4-3-5-13(14)17/h3-9,18H,2H2,1H3,(H,19,20)
InChIKeyBTJGUJTZSFQHTM-UHFFFAOYSA-N
XLogP3.12
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.29
LogP ≤ 53.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(2,6-difluorophenyl)-4-ethoxybenzohydrazide?
The IUPAC name of N'-(2,6-difluorophenyl)-4-ethoxybenzohydrazide (CID 127034362) is N'-(2,6-difluorophenyl)-4-ethoxybenzohydrazide.
What is the SMILES notation for N'-(2,6-difluorophenyl)-4-ethoxybenzohydrazide?
The canonical SMILES for N'-(2,6-difluorophenyl)-4-ethoxybenzohydrazide is CCOc1ccc(C(=O)NNc2c(F)cccc2F)cc1.
What is the InChIKey of N'-(2,6-difluorophenyl)-4-ethoxybenzohydrazide?
The InChIKey is BTJGUJTZSFQHTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O2/c1-2-21-11-8-6-10(7-9-11)15(20)19-18-14-12(16)4-3-5-13(14)17/h3-9,18H,2H2,1H3,(H,19,20).
What are the key properties of N'-(2,6-difluorophenyl)-4-ethoxybenzohydrazide?
N'-(2,6-difluorophenyl)-4-ethoxybenzohydrazide has a molecular weight of 292.29 g/mol, XLogP of 3.12, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,6-difluorophenyl)-4-ethoxybenzohydrazide is sourced from PubChem (CID 127034362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).