N-[(4-fluorophenyl)methyl]-N'-[(1R)-1-phenylethyl]oxamide

C17H17FN2O2 — CID 2201157

IUPACN-[(4-fluorophenyl)methyl]-N'-[(1R)-1-phenylethyl]oxamide
SMILESC[C@@H](NC(=O)C(=O)NCc1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C17H17FN2O2/c1-12(14-5-3-2-4-6-14)20-17(22)16(21)19-11-13-7-9-15(18)10-8-13/h2-10,12H,11H2,1H3,(H,19,21)(H,20,22)/t12-/m1/s1
InChIKeyOUWAKCDLFDSZPY-GFCCVEGCSA-N
MW300.33 g/mol
LogP2.32
Rot. Bonds4

About N-[(4-fluorophenyl)methyl]-N'-[(1R)-1-phenylethyl]oxamide

N-[(4-fluorophenyl)methyl]-N'-[(1R)-1-phenylethyl]oxamide (PubChem CID 2201157) has the molecular formula C17H17FN2O2 and a molecular weight of 300.33 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-N'-[(1R)-1-phenylethyl]oxamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-N'-[(1R)-1-phenylethyl]oxamide
PubChem CID2201157
Molecular FormulaC17H17FN2O2
Molecular Weight300.33 g/mol
Exact Mass300.13
IUPAC NameN-[(4-fluorophenyl)methyl]-N'-[(1R)-1-phenylethyl]oxamide
SMILESC[C@@H](NC(=O)C(=O)NCc1ccc(F)cc1)c1ccccc1
InChIInChI=1S/C17H17FN2O2/c1-12(14-5-3-2-4-6-14)20-17(22)16(21)19-11-13-7-9-15(18)10-8-13/h2-10,12H,11H2,1H3,(H,19,21)(H,20,22)/t12-/m1/s1
InChIKeyOUWAKCDLFDSZPY-GFCCVEGCSA-N
XLogP2.32
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.33
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[(4-fluorophenyl)methyl]-N'-[(1R)-1-phenylethyl]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

N-[(4-fluorophenyl)methyl]-N'-(1-phenylethyl)oxamide
CID 2951597
1-[(4-fluorophenyl)methyl]-3-(1-phenylethyl)urea
CID 51290878
N-[(4-chlorophenyl)methyl]-N'-(1-phenylethyl)oxamide
CID 2844386
N'-[(1R)-1-(4-fluorophenyl)ethyl]-N-[(1R)-1-phenylethyl]oxamide
CID 30405081
N-[(4-fluorophenyl)methyl]-N'-(1-phenylethyl)butanediamide
CID 3943943
N-[(4-fluorophenyl)methyl]-N'-propan-2-yloxamide
CID 44996874
1-[(4-fluorophenyl)methyl]-2-methyl-3-(1-phenylethyl)guanidine
CID 110949028
N'-[(1R)-1-(4-fluorophenyl)ethyl]-N-(furan-2-ylmethyl)oxamide
CID 30405106
N-[(2R)-2-hydroxypropyl]-N'-[(1S)-1-phenylethyl]oxamide
CID 2291148
3-(4-fluorophenyl)-N-(1-phenylethyl)propanamide
CID 47112649
N-[(4-fluorophenyl)methyl]-1-phenylethanamine
CID 2758971
3-(benzylcarbamoylamino)-N-[(1R)-1-(4-fluorophenyl)ethyl]propanamide
CID 41236910

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-N'-[(1R)-1-phenylethyl]oxamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-N'-[(1R)-1-phenylethyl]oxamide (CID 2201157) is N-[(4-fluorophenyl)methyl]-N'-[(1R)-1-phenylethyl]oxamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-N'-[(1R)-1-phenylethyl]oxamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-N'-[(1R)-1-phenylethyl]oxamide is C[C@@H](NC(=O)C(=O)NCc1ccc(F)cc1)c1ccccc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-N'-[(1R)-1-phenylethyl]oxamide?
The InChIKey is OUWAKCDLFDSZPY-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H17FN2O2/c1-12(14-5-3-2-4-6-14)20-17(22)16(21)19-11-13-7-9-15(18)10-8-13/h2-10,12H,11H2,1H3,(H,19,21)(H,20,22)/t12-/m1/s1.
What are the key properties of N-[(4-fluorophenyl)methyl]-N'-[(1R)-1-phenylethyl]oxamide?
N-[(4-fluorophenyl)methyl]-N'-[(1R)-1-phenylethyl]oxamide has a molecular weight of 300.33 g/mol, XLogP of 2.32, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-N'-[(1R)-1-phenylethyl]oxamide is sourced from PubChem (CID 2201157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).