N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide

C13H14N2O2 — CID 51311777

IUPACN-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
SMILESCNC(=O)CCc1ncc(-c2ccccc2)o1
InChIInChI=1S/C13H14N2O2/c1-14-12(16)7-8-13-15-9-11(17-13)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,14,16)
InChIKeyIROQWEHYYMGJQV-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.02
Rot. Bonds4

About N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide

N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide (PubChem CID 51311777) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide.

Molecular Properties

Compound NameN-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
PubChem CID51311777
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC NameN-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
SMILESCNC(=O)CCc1ncc(-c2ccccc2)o1
InChIInChI=1S/C13H14N2O2/c1-14-12(16)7-8-13-15-9-11(17-13)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,14,16)
InChIKeyIROQWEHYYMGJQV-UHFFFAOYSA-N
XLogP2.02
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(5-phenyl-1,3-oxazol-2-yl)-N-propylpropanamide
CID 18135781
N-[2-(ethylamino)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide;dihydrochloride
CID 119505974
N-[(2S)-1-aminopropan-2-yl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide;dihydrochloride
CID 120505530
N-(2-chlorophenyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 16590370
N-[(1S)-1-(2-hydroxyphenyl)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 51934580
2-methyl-N-[4-[3-(5-phenyl-1,3-oxazol-2-yl)propanoylamino]phenyl]propanamide
CID 41355513
N-(4-methylcyclohexyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 18136349
N-(4-phenylbutyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 18138486
N-(2-hydroxy-2,3-dimethylbutyl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 111483980
N-[(4-methylphenyl)-phenylmethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 16599378
N-[2-(2-methoxyethoxy)ethyl]-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 86985390
N-(1-methylpiperidin-4-yl)-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 30901827

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
The IUPAC name of N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide (CID 51311777) is N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide.
What is the SMILES notation for N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
The canonical SMILES for N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide is CNC(=O)CCc1ncc(-c2ccccc2)o1.
What is the InChIKey of N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
The InChIKey is IROQWEHYYMGJQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-14-12(16)7-8-13-15-9-11(17-13)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3,(H,14,16).
What are the key properties of N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide?
N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide has a molecular weight of 230.27 g/mol, XLogP of 2.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide is sourced from PubChem (CID 51311777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).