N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3-phenylpropanamide

C16H20N2O2 — CID 110718749

IUPACN-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3-phenylpropanamide
SMILESCc1nc(C)c(CCNC(=O)CCc2ccccc2)o1
InChIInChI=1S/C16H20N2O2/c1-12-15(20-13(2)18-12)10-11-17-16(19)9-8-14-6-4-3-5-7-14/h3-7H,8-11H2,1-2H3,(H,17,19)
InChIKeyMOOOFQMRDLKDFL-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.58
Rot. Bonds6

About N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3-phenylpropanamide

N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3-phenylpropanamide (PubChem CID 110718749) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3-phenylpropanamide.

Molecular Properties

Compound NameN-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3-phenylpropanamide
PubChem CID110718749
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC NameN-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3-phenylpropanamide
SMILESCc1nc(C)c(CCNC(=O)CCc2ccccc2)o1
InChIInChI=1S/C16H20N2O2/c1-12-15(20-13(2)18-12)10-11-17-16(19)9-8-14-6-4-3-5-7-14/h3-7H,8-11H2,1-2H3,(H,17,19)
InChIKeyMOOOFQMRDLKDFL-UHFFFAOYSA-N
XLogP2.58
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(3-phenylpropanoylamino)ethyl]butanamide
CID 108573772
methyl 2-methyl-5-(2-phenylethyl)-1,3-oxazole-4-carboxylate
CID 21494568
N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2,6-dimethoxybenzamide
CID 110718737
N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-2-(3-fluorophenoxy)acetamide
CID 110718805
3-(2,4-dimethyl-6-oxo-1H-pyrimidin-5-yl)-N-(2-phenylethyl)propanamide
CID 135587917
N-[2-(4-aminophenyl)ethyl]-3-phenylpropanamide
CID 39367183
N-[2-[4-(dimethylamino)phenyl]ethyl]-3-phenylpropanamide
CID 16889411
N-[(E)-pent-3-enyl]-3-phenylpropanamide
CID 101244691
N-[2-[4-methyl-6-(trifluoromethyl)pyrimidin-2-yl]ethyl]-3-phenylpropanamide
CID 71796953
N-[(4,5-dimethyl-1,3-thiazol-2-yl)methyl]-3-phenylpropanamide
CID 110441535
3-phenyl-N-[2-[1-(2-phenylethyl)benzimidazol-2-yl]ethyl]propanamide
CID 16978263
4-phenyl-N-(2-phenylethyl)butanamide;propane
CID 143447835

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3-phenylpropanamide?
The IUPAC name of N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3-phenylpropanamide (CID 110718749) is N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3-phenylpropanamide.
What is the SMILES notation for N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3-phenylpropanamide?
The canonical SMILES for N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3-phenylpropanamide is Cc1nc(C)c(CCNC(=O)CCc2ccccc2)o1.
What is the InChIKey of N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3-phenylpropanamide?
The InChIKey is MOOOFQMRDLKDFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-12-15(20-13(2)18-12)10-11-17-16(19)9-8-14-6-4-3-5-7-14/h3-7H,8-11H2,1-2H3,(H,17,19).
What are the key properties of N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3-phenylpropanamide?
N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3-phenylpropanamide has a molecular weight of 272.35 g/mol, XLogP of 2.58, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,4-dimethyl-1,3-oxazol-5-yl)ethyl]-3-phenylpropanamide is sourced from PubChem (CID 110718749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).