N'-(4-cyclohexylbutanoyl)-4-fluorobenzohydrazide

C17H23FN2O2 — CID 9340834

IUPACN'-(4-cyclohexylbutanoyl)-4-fluorobenzohydrazide
SMILESO=C(CCCC1CCCCC1)NNC(=O)c1ccc(F)cc1
InChIInChI=1S/C17H23FN2O2/c18-15-11-9-14(10-12-15)17(22)20-19-16(21)8-4-7-13-5-2-1-3-6-13/h9-13H,1-8H2,(H,19,21)(H,20,22)
InChIKeyKWKSTYQRPQBTMY-UHFFFAOYSA-N
MW306.38 g/mol
LogP3.34
Rot. Bonds5

About N'-(4-cyclohexylbutanoyl)-4-fluorobenzohydrazide

N'-(4-cyclohexylbutanoyl)-4-fluorobenzohydrazide (PubChem CID 9340834) has the molecular formula C17H23FN2O2 and a molecular weight of 306.38 g/mol. Its IUPAC name is N'-(4-cyclohexylbutanoyl)-4-fluorobenzohydrazide.

Molecular Properties

Compound NameN'-(4-cyclohexylbutanoyl)-4-fluorobenzohydrazide
PubChem CID9340834
Molecular FormulaC17H23FN2O2
Molecular Weight306.38 g/mol
Exact Mass306.17
IUPAC NameN'-(4-cyclohexylbutanoyl)-4-fluorobenzohydrazide
SMILESO=C(CCCC1CCCCC1)NNC(=O)c1ccc(F)cc1
InChIInChI=1S/C17H23FN2O2/c18-15-11-9-14(10-12-15)17(22)20-19-16(21)8-4-7-13-5-2-1-3-6-13/h9-13H,1-8H2,(H,19,21)(H,20,22)
InChIKeyKWKSTYQRPQBTMY-UHFFFAOYSA-N
XLogP3.34
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.38
LogP ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N'-(4-cyclohexylbutanoyl)benzohydrazide
CID 9414897
4-cyclohexyl-N'-[(2S)-2-(4-fluorophenoxy)propanoyl]butanehydrazide
CID 7965238
N'-(4-cyclohexylbutanoyl)-3,5-dimethoxybenzohydrazide
CID 9496167
N'-(4-cyclohexylbutanoyl)-2,4-dimethylbenzohydrazide
CID 9275952
N'-(3-cyclopentylpropanoyl)-4-nitrobenzohydrazide
CID 5418025
4-(4-cyclohexylbutanoylamino)benzoic acid
CID 10803376
N'-(3-cyclohexylpropanoyl)-3,4-dimethoxybenzohydrazide
CID 24645321
4-cyclohexyl-N'-[2-(2-methylphenoxy)acetyl]butanehydrazide
CID 9470008
4-fluoro-N'-(4-phenoxybutanoyl)benzohydrazide
CID 7732785
3-cyclohexyl-N-[(4-fluorophenyl)methyl]propanamide
CID 803650
2-[[4-(4-cyclopentylbutanoylamino)benzoyl]amino]acetic acid
CID 119220510
4-[(4-cyclopentylbutanoylamino)methyl]benzoic acid
CID 119165577

Frequently Asked Questions

What is the IUPAC name of N'-(4-cyclohexylbutanoyl)-4-fluorobenzohydrazide?
The IUPAC name of N'-(4-cyclohexylbutanoyl)-4-fluorobenzohydrazide (CID 9340834) is N'-(4-cyclohexylbutanoyl)-4-fluorobenzohydrazide.
What is the SMILES notation for N'-(4-cyclohexylbutanoyl)-4-fluorobenzohydrazide?
The canonical SMILES for N'-(4-cyclohexylbutanoyl)-4-fluorobenzohydrazide is O=C(CCCC1CCCCC1)NNC(=O)c1ccc(F)cc1.
What is the InChIKey of N'-(4-cyclohexylbutanoyl)-4-fluorobenzohydrazide?
The InChIKey is KWKSTYQRPQBTMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23FN2O2/c18-15-11-9-14(10-12-15)17(22)20-19-16(21)8-4-7-13-5-2-1-3-6-13/h9-13H,1-8H2,(H,19,21)(H,20,22).
What are the key properties of N'-(4-cyclohexylbutanoyl)-4-fluorobenzohydrazide?
N'-(4-cyclohexylbutanoyl)-4-fluorobenzohydrazide has a molecular weight of 306.38 g/mol, XLogP of 3.34, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-cyclohexylbutanoyl)-4-fluorobenzohydrazide is sourced from PubChem (CID 9340834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).