N-(4-fluoro-2-methylphenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]oxamide

C19H21FN2O3 — CID 96532470

IUPACN-(4-fluoro-2-methylphenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]oxamide
SMILESCOc1cccc(C[C@@H](C)NC(=O)C(=O)Nc2ccc(F)cc2C)c1
InChIInChI=1S/C19H21FN2O3/c1-12-9-15(20)7-8-17(12)22-19(24)18(23)21-13(2)10-14-5-4-6-16(11-14)25-3/h4-9,11,13H,10H2,1-3H3,(H,21,23)(H,22,24)/t13-/m1/s1
InChIKeyKHIYAXXYJFNHEG-CYBMUJFWSA-N
MW344.39 g/mol
LogP2.83
Rot. Bonds5

About N-(4-fluoro-2-methylphenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]oxamide

N-(4-fluoro-2-methylphenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]oxamide (PubChem CID 96532470) has the molecular formula C19H21FN2O3 and a molecular weight of 344.39 g/mol. Its IUPAC name is N-(4-fluoro-2-methylphenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]oxamide.

Molecular Properties

Compound NameN-(4-fluoro-2-methylphenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]oxamide
PubChem CID96532470
Molecular FormulaC19H21FN2O3
Molecular Weight344.39 g/mol
Exact Mass344.15
IUPAC NameN-(4-fluoro-2-methylphenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]oxamide
SMILESCOc1cccc(C[C@@H](C)NC(=O)C(=O)Nc2ccc(F)cc2C)c1
InChIInChI=1S/C19H21FN2O3/c1-12-9-15(20)7-8-17(12)22-19(24)18(23)21-13(2)10-14-5-4-6-16(11-14)25-3/h4-9,11,13H,10H2,1-3H3,(H,21,23)(H,22,24)/t13-/m1/s1
InChIKeyKHIYAXXYJFNHEG-CYBMUJFWSA-N
XLogP2.83
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.39
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(4-fluoro-2-methylphenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]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-(2-fluorophenyl)-N'-[(2S)-1-(3-methoxyphenyl)propan-2-yl]oxamide
CID 96532473
N-(2-chlorophenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]oxamide
CID 96532468
N-(4-fluoro-2-methylphenyl)-N'-[(1R)-1-(2-hydroxy-5-methoxyphenyl)ethyl]oxamide
CID 95299337
N-[1-(3-methoxyphenyl)propan-2-yl]acetamide
CID 541954
N-(4-fluoro-2-methylphenyl)-N'-propan-2-yloxamide
CID 47147961
(E)-3-(4-fluorophenyl)-N-[1-(3-methoxyphenyl)propan-2-yl]prop-2-enamide
CID 86941786
5-fluoro-N-[1-(3-methoxyphenyl)propan-2-yl]-1-benzofuran-2-carboxamide
CID 86967824
1-(3,4-difluorophenyl)-3-[1-(3-methoxyphenyl)propan-2-yl]urea
CID 86943626
4-(4-fluorophenoxy)-N-[1-(3-methoxyphenyl)propan-2-yl]butanamide
CID 86941749
(E)-3-(3-fluorophenyl)-N-[1-(3-methoxyphenyl)propan-2-yl]prop-2-enamide
CID 86941753
1-[cyclopropyl-(4-fluorophenyl)methyl]-3-[1-(3-methoxyphenyl)propan-2-yl]urea
CID 86943269
N-(5-chloro-2-piperidin-1-ylphenyl)-N'-[1-(3-methoxyphenyl)propan-2-yl]oxamide
CID 86943894

Frequently Asked Questions

What is the IUPAC name of N-(4-fluoro-2-methylphenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]oxamide?
The IUPAC name of N-(4-fluoro-2-methylphenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]oxamide (CID 96532470) is N-(4-fluoro-2-methylphenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]oxamide.
What is the SMILES notation for N-(4-fluoro-2-methylphenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]oxamide?
The canonical SMILES for N-(4-fluoro-2-methylphenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]oxamide is COc1cccc(C[C@@H](C)NC(=O)C(=O)Nc2ccc(F)cc2C)c1.
What is the InChIKey of N-(4-fluoro-2-methylphenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]oxamide?
The InChIKey is KHIYAXXYJFNHEG-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H21FN2O3/c1-12-9-15(20)7-8-17(12)22-19(24)18(23)21-13(2)10-14-5-4-6-16(11-14)25-3/h4-9,11,13H,10H2,1-3H3,(H,21,23)(H,22,24)/t13-/m1/s1.
What are the key properties of N-(4-fluoro-2-methylphenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]oxamide?
N-(4-fluoro-2-methylphenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]oxamide has a molecular weight of 344.39 g/mol, XLogP of 2.83, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-2-methylphenyl)-N'-[(2R)-1-(3-methoxyphenyl)propan-2-yl]oxamide is sourced from PubChem (CID 96532470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).