N-[(4-ethylphenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide

C22H24N2O2 — CID 134011097

IUPACN-[(4-ethylphenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
SMILESCCc1ccc(CN(C)C(=O)CCc2ncc(-c3ccccc3)o2)cc1
InChIInChI=1S/C22H24N2O2/c1-3-17-9-11-18(12-10-17)16-24(2)22(25)14-13-21-23-15-20(26-21)19-7-5-4-6-8-19/h4-12,15H,3,13-14,16H2,1-2H3
InChIKeyXWDZPCGSGSKTBT-UHFFFAOYSA-N
MW348.45 g/mol
LogP4.50
Rot. Bonds7

About N-[(4-ethylphenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide

N-[(4-ethylphenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide (PubChem CID 134011097) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is N-[(4-ethylphenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide.

Molecular Properties

Compound NameN-[(4-ethylphenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
PubChem CID134011097
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC NameN-[(4-ethylphenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
SMILESCCc1ccc(CN(C)C(=O)CCc2ncc(-c3ccccc3)o2)cc1
InChIInChI=1S/C22H24N2O2/c1-3-17-9-11-18(12-10-17)16-24(2)22(25)14-13-21-23-15-20(26-21)19-7-5-4-6-8-19/h4-12,15H,3,13-14,16H2,1-2H3
InChIKeyXWDZPCGSGSKTBT-UHFFFAOYSA-N
XLogP4.50
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-fluorophenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 51075029
N-methyl-N-[(2-methylfuran-3-yl)methyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 51092081
N-benzyl-N-phenyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 29438436
2-methyl-5-[[methyl-[3-(5-phenyl-1,3-oxazol-2-yl)propanoyl]amino]methyl]furan-3-carboxylic acid
CID 119221891
N-benzyl-N-(2-methoxyethyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 94562085
N-[2-(tert-butylamino)-2-oxoethyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 18137364
3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]propanamide
CID 31850784
N-benzyl-3-[5-(2,4-dichlorophenyl)-1,3-oxazol-2-yl]-N-methylpropanamide
CID 29413645
3-[5-(2-chlorophenyl)-1,3-oxazol-2-yl]-N-methyl-N-[(4-methylsulfanylphenyl)methyl]propanamide
CID 24651784
N-[2-(3,5-dimethylphenoxy)ethyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 18157368
N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)-N-pyrrolidin-3-ylpropanamide;dihydrochloride
CID 119551279
N-[(3,4-dimethoxyphenyl)methyl]-3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]-N-methylpropanamide
CID 18145565

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylphenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
The IUPAC name of N-[(4-ethylphenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide (CID 134011097) is N-[(4-ethylphenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide.
What is the SMILES notation for N-[(4-ethylphenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
The canonical SMILES for N-[(4-ethylphenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide is CCc1ccc(CN(C)C(=O)CCc2ncc(-c3ccccc3)o2)cc1.
What is the InChIKey of N-[(4-ethylphenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
The InChIKey is XWDZPCGSGSKTBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-3-17-9-11-18(12-10-17)16-24(2)22(25)14-13-21-23-15-20(26-21)19-7-5-4-6-8-19/h4-12,15H,3,13-14,16H2,1-2H3.
What are the key properties of N-[(4-ethylphenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
N-[(4-ethylphenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide has a molecular weight of 348.45 g/mol, XLogP of 4.50, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylphenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide is sourced from PubChem (CID 134011097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).