cyclohexyl 4-[(4-fluorobenzoyl)amino]benzoate

C20H20FNO3 — CID 17128629

IUPACcyclohexyl 4-[(4-fluorobenzoyl)amino]benzoate
SMILESO=C(Nc1ccc(C(=O)OC2CCCCC2)cc1)c1ccc(F)cc1
InChIInChI=1S/C20H20FNO3/c21-16-10-6-14(7-11-16)19(23)22-17-12-8-15(9-13-17)20(24)25-18-4-2-1-3-5-18/h6-13,18H,1-5H2,(H,22,23)
InChIKeyNUGWLMFYMYFOTK-UHFFFAOYSA-N
MW341.38 g/mol
LogP4.57
Rot. Bonds4

About cyclohexyl 4-[(4-fluorobenzoyl)amino]benzoate

cyclohexyl 4-[(4-fluorobenzoyl)amino]benzoate (PubChem CID 17128629) has the molecular formula C20H20FNO3 and a molecular weight of 341.38 g/mol. Its IUPAC name is cyclohexyl 4-[(4-fluorobenzoyl)amino]benzoate.

Molecular Properties

Compound Namecyclohexyl 4-[(4-fluorobenzoyl)amino]benzoate
PubChem CID17128629
Molecular FormulaC20H20FNO3
Molecular Weight341.38 g/mol
Exact Mass341.14
IUPAC Namecyclohexyl 4-[(4-fluorobenzoyl)amino]benzoate
SMILESO=C(Nc1ccc(C(=O)OC2CCCCC2)cc1)c1ccc(F)cc1
InChIInChI=1S/C20H20FNO3/c21-16-10-6-14(7-11-16)19(23)22-17-12-8-15(9-13-17)20(24)25-18-4-2-1-3-5-18/h6-13,18H,1-5H2,(H,22,23)
InChIKeyNUGWLMFYMYFOTK-UHFFFAOYSA-N
XLogP4.57
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.38
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze cyclohexyl 4-[(4-fluorobenzoyl)amino]benzoate 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

cyclohexyl 4-[(4-chlorobenzoyl)amino]benzoate
CID 17128630
cyclohexyl 4-(pyridine-4-carbonylamino)benzoate
CID 719338
piperidin-4-yl 4-[(4-fluorobenzoyl)amino]benzoate;hydrochloride
CID 91645336
cyclopentyl 4-fluorobenzoate
CID 579482
cyclododecyl 4-acetamidobenzoate
CID 3973983
cyclohexyl 4-[(4-propoxybenzoyl)amino]benzoate
CID 17128650
cyclohexyl 4-[(3,4-dimethoxybenzoyl)amino]benzoate
CID 985959
cyclohexyl (2R)-2-[4-[(4-fluorophenyl)carbamoyl]phenoxy]propanoate
CID 7695417
cyclohexyl (2S)-2-[4-[(4-fluorophenyl)carbamoyl]phenoxy]propanoate
CID 7695414
cyclohexyl 4-[(2-aminoacetyl)amino]benzoate
CID 110459441
cyclopropyl 4-fluorobenzoate
CID 126986458
cyclohexyl 4-(dimethylcarbamoylamino)benzoate
CID 110443782

Frequently Asked Questions

What is the IUPAC name of cyclohexyl 4-[(4-fluorobenzoyl)amino]benzoate?
The IUPAC name of cyclohexyl 4-[(4-fluorobenzoyl)amino]benzoate (CID 17128629) is cyclohexyl 4-[(4-fluorobenzoyl)amino]benzoate.
What is the SMILES notation for cyclohexyl 4-[(4-fluorobenzoyl)amino]benzoate?
The canonical SMILES for cyclohexyl 4-[(4-fluorobenzoyl)amino]benzoate is O=C(Nc1ccc(C(=O)OC2CCCCC2)cc1)c1ccc(F)cc1.
What is the InChIKey of cyclohexyl 4-[(4-fluorobenzoyl)amino]benzoate?
The InChIKey is NUGWLMFYMYFOTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20FNO3/c21-16-10-6-14(7-11-16)19(23)22-17-12-8-15(9-13-17)20(24)25-18-4-2-1-3-5-18/h6-13,18H,1-5H2,(H,22,23).
What are the key properties of cyclohexyl 4-[(4-fluorobenzoyl)amino]benzoate?
cyclohexyl 4-[(4-fluorobenzoyl)amino]benzoate has a molecular weight of 341.38 g/mol, XLogP of 4.57, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl 4-[(4-fluorobenzoyl)amino]benzoate is sourced from PubChem (CID 17128629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).