N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-phenoxypropanamide

C15H18N2O3 — CID 71789706

IUPACN-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-phenoxypropanamide
SMILESCc1cc(CCNC(=O)C(C)Oc2ccccc2)on1
InChIInChI=1S/C15H18N2O3/c1-11-10-14(20-17-11)8-9-16-15(18)12(2)19-13-6-4-3-5-7-13/h3-7,10,12H,8-9H2,1-2H3,(H,16,18)
InChIKeyKHJFGYVEAXNINJ-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.11
Rot. Bonds6

About N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-phenoxypropanamide

N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-phenoxypropanamide (PubChem CID 71789706) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-phenoxypropanamide.

Molecular Properties

Compound NameN-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-phenoxypropanamide
PubChem CID71789706
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC NameN-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-phenoxypropanamide
SMILESCc1cc(CCNC(=O)C(C)Oc2ccccc2)on1
InChIInChI=1S/C15H18N2O3/c1-11-10-14(20-17-11)8-9-16-15(18)12(2)19-13-6-4-3-5-7-13/h3-7,10,12H,8-9H2,1-2H3,(H,16,18)
InChIKeyKHJFGYVEAXNINJ-UHFFFAOYSA-N
XLogP2.11
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-phenoxypropanamide?
The IUPAC name of N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-phenoxypropanamide (CID 71789706) is N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-phenoxypropanamide.
What is the SMILES notation for N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-phenoxypropanamide?
The canonical SMILES for N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-phenoxypropanamide is Cc1cc(CCNC(=O)C(C)Oc2ccccc2)on1.
What is the InChIKey of N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-phenoxypropanamide?
The InChIKey is KHJFGYVEAXNINJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-11-10-14(20-17-11)8-9-16-15(18)12(2)19-13-6-4-3-5-7-13/h3-7,10,12H,8-9H2,1-2H3,(H,16,18).
What are the key properties of N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-phenoxypropanamide?
N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-phenoxypropanamide has a molecular weight of 274.32 g/mol, XLogP of 2.11, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-methyl-1,2-oxazol-5-yl)ethyl]-2-phenoxypropanamide is sourced from PubChem (CID 71789706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).