3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide

C17H18N4O2 — CID 55867560

IUPAC3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide
SMILESCc1ccc(-c2cnc(CCC(=O)Nc3cc(C)[nH]n3)o2)cc1
InChIInChI=1S/C17H18N4O2/c1-11-3-5-13(6-4-11)14-10-18-17(23-14)8-7-16(22)19-15-9-12(2)20-21-15/h3-6,9-10H,7-8H2,1-2H3,(H2,19,20,21,22)
InChIKeyLJTCHEAZJSVQFD-UHFFFAOYSA-N
MW310.36 g/mol
LogP3.25
Rot. Bonds5

About 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide

3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide (PubChem CID 55867560) has the molecular formula C17H18N4O2 and a molecular weight of 310.36 g/mol. Its IUPAC name is 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide.

Molecular Properties

Compound Name3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide
PubChem CID55867560
Molecular FormulaC17H18N4O2
Molecular Weight310.36 g/mol
Exact Mass310.14
IUPAC Name3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide
SMILESCc1ccc(-c2cnc(CCC(=O)Nc3cc(C)[nH]n3)o2)cc1
InChIInChI=1S/C17H18N4O2/c1-11-3-5-13(6-4-11)14-10-18-17(23-14)8-7-16(22)19-15-9-12(2)20-21-15/h3-6,9-10H,7-8H2,1-2H3,(H2,19,20,21,22)
InChIKeyLJTCHEAZJSVQFD-UHFFFAOYSA-N
XLogP3.25
TPSA83.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.36
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-fluoro-2-methylphenyl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide
CID 41356754
N-(3-acetamidophenyl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide
CID 17422468
N-(2,4-dimethylphenyl)-3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propanamide
CID 17438164
3-[5-(4-chlorophenyl)-1,3-oxazol-2-yl]-N-(4-methylphenyl)propanamide
CID 16590390
N-(3,5-dimethoxyphenyl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide
CID 17422470
N-(2-chloro-4,6-dimethylphenyl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide
CID 16593882
3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(3-methylsulfonylphenyl)propanamide
CID 34237447
3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(1,3,4-thiadiazol-2-yl)propanamide
CID 29370697
N-(3,5-dimethyl-1,2-oxazol-4-yl)-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide
CID 47083852
N-[4-[2-(methylamino)-2-oxoethyl]phenyl]-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide
CID 38404443
N-ethoxy-3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanamide
CID 51316585
5-[3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]propanoylamino]pentanoic acid
CID 119235078

Frequently Asked Questions

What is the IUPAC name of 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
The IUPAC name of 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide (CID 55867560) is 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide.
What is the SMILES notation for 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
The canonical SMILES for 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide is Cc1ccc(-c2cnc(CCC(=O)Nc3cc(C)[nH]n3)o2)cc1.
What is the InChIKey of 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
The InChIKey is LJTCHEAZJSVQFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N4O2/c1-11-3-5-13(6-4-11)14-10-18-17(23-14)8-7-16(22)19-15-9-12(2)20-21-15/h3-6,9-10H,7-8H2,1-2H3,(H2,19,20,21,22).
What are the key properties of 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide?
3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide has a molecular weight of 310.36 g/mol, XLogP of 3.25, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(4-methylphenyl)-1,3-oxazol-2-yl]-N-(5-methyl-1H-pyrazol-3-yl)propanamide is sourced from PubChem (CID 55867560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).