2,3-bis(4-fluorophenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide

C21H20F2N2O2 — CID 110310825

IUPAC2,3-bis(4-fluorophenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide
SMILESCc1cc(CCNC(=O)C(Cc2ccc(F)cc2)c2ccc(F)cc2)no1
InChIInChI=1S/C21H20F2N2O2/c1-14-12-19(25-27-14)10-11-24-21(26)20(16-4-8-18(23)9-5-16)13-15-2-6-17(22)7-3-15/h2-9,12,20H,10-11,13H2,1H3,(H,24,26)
InChIKeyJQWJPAUDFWHKMD-UHFFFAOYSA-N
MW370.40 g/mol
LogP3.95
Rot. Bonds7

About 2,3-bis(4-fluorophenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide

2,3-bis(4-fluorophenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide (PubChem CID 110310825) has the molecular formula C21H20F2N2O2 and a molecular weight of 370.40 g/mol. Its IUPAC name is 2,3-bis(4-fluorophenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide.

Molecular Properties

Compound Name2,3-bis(4-fluorophenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide
PubChem CID110310825
Molecular FormulaC21H20F2N2O2
Molecular Weight370.40 g/mol
Exact Mass370.15
IUPAC Name2,3-bis(4-fluorophenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide
SMILESCc1cc(CCNC(=O)C(Cc2ccc(F)cc2)c2ccc(F)cc2)no1
InChIInChI=1S/C21H20F2N2O2/c1-14-12-19(25-27-14)10-11-24-21(26)20(16-4-8-18(23)9-5-16)13-15-2-6-17(22)7-3-15/h2-9,12,20H,10-11,13H2,1H3,(H,24,26)
InChIKeyJQWJPAUDFWHKMD-UHFFFAOYSA-N
XLogP3.95
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.40
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]-2-phenyl-3-pyridin-3-ylpropanamide
CID 110632380
3-(4-fluorophenyl)-N-[(5-methyl-1,2-oxazol-3-yl)methyl]propanamide
CID 47729327
2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide
CID 110296524
4-methyl-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]-3-(4-methylphenyl)pentanamide
CID 110354876
2-[2-(4-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]acetamide
CID 110632372
3-(4-fluorophenyl)-3-[[2-(5-methyl-1,2-oxazol-3-yl)acetyl]amino]propanoic acid
CID 91647036
2-(4-fluorophenyl)-N-[2-(2-methyl-1,3-thiazol-4-yl)ethyl]butanamide
CID 110353144
2-(4-fluorophenyl)-N-[2-(5-phenyl-1,2-oxazol-3-yl)ethyl]acetamide
CID 110314644
N-[3-(4-fluorophenyl)-1-oxo-1-(2-oxoethylamino)propan-2-yl]-5-methyl-1,2-oxazole-3-carboxamide
CID 167480989
2-[2-(4-fluorophenyl)ethylamino]-N-(5-methyl-1,2-oxazol-3-yl)-2-phenylacetamide
CID 86913137
2-(4-fluorophenyl)-3-pyridin-3-yl-N-[2-(1,3-thiazol-4-yl)ethyl]propanamide
CID 110305024
3-[(1R)-1-(4-fluorophenyl)-3,3-dimethylbutyl]-1-methyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]urea
CID 94117105

Frequently Asked Questions

What is the IUPAC name of 2,3-bis(4-fluorophenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide?
The IUPAC name of 2,3-bis(4-fluorophenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide (CID 110310825) is 2,3-bis(4-fluorophenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide.
What is the SMILES notation for 2,3-bis(4-fluorophenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide?
The canonical SMILES for 2,3-bis(4-fluorophenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide is Cc1cc(CCNC(=O)C(Cc2ccc(F)cc2)c2ccc(F)cc2)no1.
What is the InChIKey of 2,3-bis(4-fluorophenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide?
The InChIKey is JQWJPAUDFWHKMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20F2N2O2/c1-14-12-19(25-27-14)10-11-24-21(26)20(16-4-8-18(23)9-5-16)13-15-2-6-17(22)7-3-15/h2-9,12,20H,10-11,13H2,1H3,(H,24,26).
What are the key properties of 2,3-bis(4-fluorophenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide?
2,3-bis(4-fluorophenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide has a molecular weight of 370.40 g/mol, XLogP of 3.95, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-bis(4-fluorophenyl)-N-[2-(5-methyl-1,2-oxazol-3-yl)ethyl]propanamide is sourced from PubChem (CID 110310825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).