(2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-1-(2-fluorophenoxy)propan-2-yl]butanamide

C18H23FN2O3 — CID 95285859

IUPAC(2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-1-(2-fluorophenoxy)propan-2-yl]butanamide
SMILESCC[C@@H](C(=O)N[C@@H](C)COc1ccccc1F)c1c(C)noc1C
InChIInChI=1S/C18H23FN2O3/c1-5-14(17-12(3)21-24-13(17)4)18(22)20-11(2)10-23-16-9-7-6-8-15(16)19/h6-9,11,14H,5,10H2,1-4H3,(H,20,22)/t11-,14+/m0/s1
InChIKeySOHMPGMQTVNPBI-SMDDNHRTSA-N
MW334.39 g/mol
LogP3.51
Rot. Bonds7

About (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-1-(2-fluorophenoxy)propan-2-yl]butanamide

(2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-1-(2-fluorophenoxy)propan-2-yl]butanamide (PubChem CID 95285859) has the molecular formula C18H23FN2O3 and a molecular weight of 334.39 g/mol. Its IUPAC name is (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-1-(2-fluorophenoxy)propan-2-yl]butanamide.

Molecular Properties

Compound Name(2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-1-(2-fluorophenoxy)propan-2-yl]butanamide
PubChem CID95285859
Molecular FormulaC18H23FN2O3
Molecular Weight334.39 g/mol
Exact Mass334.17
IUPAC Name(2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-1-(2-fluorophenoxy)propan-2-yl]butanamide
SMILESCC[C@@H](C(=O)N[C@@H](C)COc1ccccc1F)c1c(C)noc1C
InChIInChI=1S/C18H23FN2O3/c1-5-14(17-12(3)21-24-13(17)4)18(22)20-11(2)10-23-16-9-7-6-8-15(16)19/h6-9,11,14H,5,10H2,1-4H3,(H,20,22)/t11-,14+/m0/s1
InChIKeySOHMPGMQTVNPBI-SMDDNHRTSA-N
XLogP3.51
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.39
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-1-(2-fluorophenoxy)propan-2-yl]butanamide 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

1-[(1R)-1-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-3-[3-(2-fluorophenoxy)propyl]urea
CID 95904909
N'-[(2S)-2-(3,5-dimethyl-1,2-oxazol-4-yl)butanoyl]benzohydrazide
CID 95977615
3,5-dimethyl-N-[(2R)-1-[2-(trifluoromethyl)phenoxy]propan-2-yl]-1,2-oxazole-4-carboxamide
CID 94621379
2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide
CID 94623553
1-[(2R)-1-(2-fluorophenoxy)propan-2-yl]-3-[(3-propan-2-yl-1,2-oxazol-5-yl)methyl]urea
CID 96548941
(2R)-N-[(2R)-1-(2-fluorophenoxy)propan-2-yl]-2-[[(2S)-oxan-2-yl]methoxy]propanamide
CID 95154419
2-(3,5-dimethyl-1,2-oxazol-4-yl)butanoic acid
CID 47003039
(2S)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-fluoro-2-nitrophenyl)butanamide
CID 95977922
2-(2-methylphenoxy)-N-[1-(2-methylphenoxy)propan-2-yl]butanamide
CID 132652224
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-methyl-1,2-oxazol-3-yl)butanamide
CID 132970595
(2S)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[4-methoxy-3-(2-methoxyethoxy)phenyl]butanamide
CID 52510455
(2S)-2-(2-fluorophenoxy)-N-(3-methyl-[1,2]oxazolo[5,4-b]pyridin-5-yl)butanamide
CID 97319412

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-1-(2-fluorophenoxy)propan-2-yl]butanamide?
The IUPAC name of (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-1-(2-fluorophenoxy)propan-2-yl]butanamide (CID 95285859) is (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-1-(2-fluorophenoxy)propan-2-yl]butanamide.
What is the SMILES notation for (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-1-(2-fluorophenoxy)propan-2-yl]butanamide?
The canonical SMILES for (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-1-(2-fluorophenoxy)propan-2-yl]butanamide is CC[C@@H](C(=O)N[C@@H](C)COc1ccccc1F)c1c(C)noc1C.
What is the InChIKey of (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-1-(2-fluorophenoxy)propan-2-yl]butanamide?
The InChIKey is SOHMPGMQTVNPBI-SMDDNHRTSA-N. The full InChI is InChI=1S/C18H23FN2O3/c1-5-14(17-12(3)21-24-13(17)4)18(22)20-11(2)10-23-16-9-7-6-8-15(16)19/h6-9,11,14H,5,10H2,1-4H3,(H,20,22)/t11-,14+/m0/s1.
What are the key properties of (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-1-(2-fluorophenoxy)propan-2-yl]butanamide?
(2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-1-(2-fluorophenoxy)propan-2-yl]butanamide has a molecular weight of 334.39 g/mol, XLogP of 3.51, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[(2S)-1-(2-fluorophenoxy)propan-2-yl]butanamide is sourced from PubChem (CID 95285859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).