N-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide

C23H27FN2O3 — CID 43886444

IUPACN-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide
SMILESCCC(Oc1ccc(F)cc1)C(=O)Nc1ccccc1C(=O)NC1CCCCC1
InChIInChI=1S/C23H27FN2O3/c1-2-21(29-18-14-12-16(24)13-15-18)23(28)26-20-11-7-6-10-19(20)22(27)25-17-8-4-3-5-9-17/h6-7,10-15,17,21H,2-5,8-9H2,1H3,(H,25,27)(H,26,28)
InChIKeySELTZGFOFSXRQR-UHFFFAOYSA-N
MW398.48 g/mol
LogP4.68
Rot. Bonds7

About N-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide

N-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide (PubChem CID 43886444) has the molecular formula C23H27FN2O3 and a molecular weight of 398.48 g/mol. Its IUPAC name is N-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide
PubChem CID43886444
Molecular FormulaC23H27FN2O3
Molecular Weight398.48 g/mol
Exact Mass398.20
IUPAC NameN-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide
SMILESCCC(Oc1ccc(F)cc1)C(=O)Nc1ccccc1C(=O)NC1CCCCC1
InChIInChI=1S/C23H27FN2O3/c1-2-21(29-18-14-12-16(24)13-15-18)23(28)26-20-11-7-6-10-19(20)22(27)25-17-8-4-3-5-9-17/h6-7,10-15,17,21H,2-5,8-9H2,1H3,(H,25,27)(H,26,28)
InChIKeySELTZGFOFSXRQR-UHFFFAOYSA-N
XLogP4.68
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.48
LogP ≤ 54.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide 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-cyclohexyl-2-[2-(4-methoxyphenoxy)butanoylamino]benzamide
CID 21368361
2-[2-(4-tert-butylphenoxy)butanoylamino]-N-cyclohexylbenzamide
CID 132670970
N-cyclohexyl-2-[[(2R)-2-(3-methoxyphenoxy)butanoyl]amino]benzamide
CID 94012414
(2R)-N-cyclohexyl-2-(4-fluorophenoxy)butanamide
CID 28569448
N-cyclopropyl-2-[[(2S)-2-(4-fluorophenoxy)propanoyl]amino]benzamide
CID 26905849
2-[2-(4-fluorophenoxy)butanoylamino]benzamide
CID 43906030
N-butyl-2-[[(2S)-2-(4-fluorophenoxy)butanoyl]amino]benzamide
CID 28632385
2-[2-(4-fluorophenoxy)butanoylamino]-N-(oxolan-2-ylmethyl)benzamide
CID 133255501
N-(2-benzoylphenyl)-2-(4-fluorophenoxy)butanamide
CID 132656695
N-cyclohexyl-2-[[(2R)-2-(4-methylphenoxy)propanoyl]amino]benzamide
CID 2236056
N-(2-chlorophenyl)-2-(4-fluorophenoxy)butanamide
CID 46771035
2-[[(2S)-2-chloropropanoyl]amino]-N-cyclohexylbenzamide
CID 92660383

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide?
The IUPAC name of N-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide (CID 43886444) is N-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide.
What is the SMILES notation for N-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide?
The canonical SMILES for N-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide is CCC(Oc1ccc(F)cc1)C(=O)Nc1ccccc1C(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide?
The InChIKey is SELTZGFOFSXRQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H27FN2O3/c1-2-21(29-18-14-12-16(24)13-15-18)23(28)26-20-11-7-6-10-19(20)22(27)25-17-8-4-3-5-9-17/h6-7,10-15,17,21H,2-5,8-9H2,1H3,(H,25,27)(H,26,28).
What are the key properties of N-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide?
N-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide has a molecular weight of 398.48 g/mol, XLogP of 4.68, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[2-(4-fluorophenoxy)butanoylamino]benzamide is sourced from PubChem (CID 43886444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).