N-[[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-2-methyl-N-propylpropanamide

C19H26N2O2 — CID 51070279

IUPACN-[[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-2-methyl-N-propylpropanamide
SMILESCCCN(Cc1cc(-c2cc(C)ccc2C)on1)C(=O)C(C)C
InChIInChI=1S/C19H26N2O2/c1-6-9-21(19(22)13(2)3)12-16-11-18(23-20-16)17-10-14(4)7-8-15(17)5/h7-8,10-11,13H,6,9,12H2,1-5H3
InChIKeyOZAMSXOPEQFARL-UHFFFAOYSA-N
MW314.43 g/mol
LogP4.35
Rot. Bonds6

About N-[[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-2-methyl-N-propylpropanamide

N-[[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-2-methyl-N-propylpropanamide (PubChem CID 51070279) has the molecular formula C19H26N2O2 and a molecular weight of 314.43 g/mol. Its IUPAC name is N-[[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-2-methyl-N-propylpropanamide.

Molecular Properties

Compound NameN-[[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-2-methyl-N-propylpropanamide
PubChem CID51070279
Molecular FormulaC19H26N2O2
Molecular Weight314.43 g/mol
Exact Mass314.20
IUPAC NameN-[[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-2-methyl-N-propylpropanamide
SMILESCCCN(Cc1cc(-c2cc(C)ccc2C)on1)C(=O)C(C)C
InChIInChI=1S/C19H26N2O2/c1-6-9-21(19(22)13(2)3)12-16-11-18(23-20-16)17-10-14(4)7-8-15(17)5/h7-8,10-11,13H,6,9,12H2,1-5H3
InChIKeyOZAMSXOPEQFARL-UHFFFAOYSA-N
XLogP4.35
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.43
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methanamine
CID 28808393
N-[[5-(3,4-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-4-methyl-N-propylbenzamide
CID 51070319
2-chloro-N-[[5-(2,4-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-N-propylbenzamide
CID 83281968
N-[[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-N-(2-methoxyethyl)thiophene-2-carboxamide
CID 51070242
N-[(5-phenyl-1,2-oxazol-3-yl)methyl]-N-propylacetamide
CID 42656369
1-benzyl-1-[[5-(2,4-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-3-propan-2-ylurea
CID 51070614
1-[[5-(2,4-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-1-[(4-fluorophenyl)methyl]-3-propan-2-ylurea
CID 51070626
N-[[5-(2,4-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-N-(2-methoxyethyl)benzamide
CID 51070364
5-(2,5-dimethylphenyl)-3-methyl-1,2-oxazole
CID 116868891
3-tert-butyl-1-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]-1-propylurea
CID 83281969
N-benzyl-N-[[5-(4-methoxyphenyl)-1,2-oxazol-3-yl]methyl]-2-methylpropanamide
CID 42822314
N-[[5-(3,4-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-4-methyl-N-propan-2-ylbenzamide
CID 51070040

Frequently Asked Questions

What is the IUPAC name of N-[[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-2-methyl-N-propylpropanamide?
The IUPAC name of N-[[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-2-methyl-N-propylpropanamide (CID 51070279) is N-[[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-2-methyl-N-propylpropanamide.
What is the SMILES notation for N-[[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-2-methyl-N-propylpropanamide?
The canonical SMILES for N-[[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-2-methyl-N-propylpropanamide is CCCN(Cc1cc(-c2cc(C)ccc2C)on1)C(=O)C(C)C.
What is the InChIKey of N-[[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-2-methyl-N-propylpropanamide?
The InChIKey is OZAMSXOPEQFARL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N2O2/c1-6-9-21(19(22)13(2)3)12-16-11-18(23-20-16)17-10-14(4)7-8-15(17)5/h7-8,10-11,13H,6,9,12H2,1-5H3.
What are the key properties of N-[[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-2-methyl-N-propylpropanamide?
N-[[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-2-methyl-N-propylpropanamide has a molecular weight of 314.43 g/mol, XLogP of 4.35, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(2,5-dimethylphenyl)-1,2-oxazol-3-yl]methyl]-2-methyl-N-propylpropanamide is sourced from PubChem (CID 51070279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).