N'-cyclohexyl-N-[2-(4-fluorophenyl)ethyl]oxamide

C16H21FN2O2 — CID 2059080

IUPACN'-cyclohexyl-N-[2-(4-fluorophenyl)ethyl]oxamide
SMILESO=C(NCCc1ccc(F)cc1)C(=O)NC1CCCCC1
InChIInChI=1S/C16H21FN2O2/c17-13-8-6-12(7-9-13)10-11-18-15(20)16(21)19-14-4-2-1-3-5-14/h6-9,14H,1-5,10-11H2,(H,18,20)(H,19,21)
InChIKeyUNERXRIGCIVLMB-UHFFFAOYSA-N
MW292.35 g/mol
LogP1.93
Rot. Bonds4

About N'-cyclohexyl-N-[2-(4-fluorophenyl)ethyl]oxamide

N'-cyclohexyl-N-[2-(4-fluorophenyl)ethyl]oxamide (PubChem CID 2059080) has the molecular formula C16H21FN2O2 and a molecular weight of 292.35 g/mol. Its IUPAC name is N'-cyclohexyl-N-[2-(4-fluorophenyl)ethyl]oxamide.

Molecular Properties

Compound NameN'-cyclohexyl-N-[2-(4-fluorophenyl)ethyl]oxamide
PubChem CID2059080
Molecular FormulaC16H21FN2O2
Molecular Weight292.35 g/mol
Exact Mass292.16
IUPAC NameN'-cyclohexyl-N-[2-(4-fluorophenyl)ethyl]oxamide
SMILESO=C(NCCc1ccc(F)cc1)C(=O)NC1CCCCC1
InChIInChI=1S/C16H21FN2O2/c17-13-8-6-12(7-9-13)10-11-18-15(20)16(21)19-14-4-2-1-3-5-14/h6-9,14H,1-5,10-11H2,(H,18,20)(H,19,21)
InChIKeyUNERXRIGCIVLMB-UHFFFAOYSA-N
XLogP1.93
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.35
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

Analyze N'-cyclohexyl-N-[2-(4-fluorophenyl)ethyl]oxamide 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

Lisdexamfetamine
CID 11597698
Acetylamphetamine
CID 26660
cyclo(L-leucyl-L-phenylalanyl)
CID 7076347
Cyclo(-Gly-Phe)
CID 7076549
(3R)-4-((3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl)-3-methyl-1,4-diazepan-2-one
CID 10450114
Leucyl-phenylalanine amide
CID 3082491
N-(1-Methyl-3-phenylpropyl)acetamide
CID 541808
N,N'-Dibenzyloxamide
CID 219253
(3R)-4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-benzyl-1,4-diazepan-2-one
CID 23646450
Phenylalanylphenylalanylamide
CID 85169
(D)-Phe-(D)-Phe-NH2
CID 7037588
(L)-Phe-(D)-Phe-NH2
CID 7088460

Frequently Asked Questions

What is the IUPAC name of N'-cyclohexyl-N-[2-(4-fluorophenyl)ethyl]oxamide?
The IUPAC name of N'-cyclohexyl-N-[2-(4-fluorophenyl)ethyl]oxamide (CID 2059080) is N'-cyclohexyl-N-[2-(4-fluorophenyl)ethyl]oxamide.
What is the SMILES notation for N'-cyclohexyl-N-[2-(4-fluorophenyl)ethyl]oxamide?
The canonical SMILES for N'-cyclohexyl-N-[2-(4-fluorophenyl)ethyl]oxamide is O=C(NCCc1ccc(F)cc1)C(=O)NC1CCCCC1.
What is the InChIKey of N'-cyclohexyl-N-[2-(4-fluorophenyl)ethyl]oxamide?
The InChIKey is UNERXRIGCIVLMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21FN2O2/c17-13-8-6-12(7-9-13)10-11-18-15(20)16(21)19-14-4-2-1-3-5-14/h6-9,14H,1-5,10-11H2,(H,18,20)(H,19,21).
What are the key properties of N'-cyclohexyl-N-[2-(4-fluorophenyl)ethyl]oxamide?
N'-cyclohexyl-N-[2-(4-fluorophenyl)ethyl]oxamide has a molecular weight of 292.35 g/mol, XLogP of 1.93, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclohexyl-N-[2-(4-fluorophenyl)ethyl]oxamide is sourced from PubChem (CID 2059080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).