2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methoxy]phenoxy]propanamide

C15H18N2O4 — CID 71996890

IUPAC2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methoxy]phenoxy]propanamide
SMILESCc1nc(COc2ccc(OC(C)C(N)=O)cc2)oc1C
InChIInChI=1S/C15H18N2O4/c1-9-10(2)21-14(17-9)8-19-12-4-6-13(7-5-12)20-11(3)15(16)18/h4-7,11H,8H2,1-3H3,(H2,16,18)
InChIKeyZKTVSOQQPAJLAK-UHFFFAOYSA-N
MW290.32 g/mol
LogP2.12
Rot. Bonds6

About 2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methoxy]phenoxy]propanamide

2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methoxy]phenoxy]propanamide (PubChem CID 71996890) has the molecular formula C15H18N2O4 and a molecular weight of 290.32 g/mol. Its IUPAC name is 2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methoxy]phenoxy]propanamide.

Molecular Properties

Compound Name2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methoxy]phenoxy]propanamide
PubChem CID71996890
Molecular FormulaC15H18N2O4
Molecular Weight290.32 g/mol
Exact Mass290.13
IUPAC Name2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methoxy]phenoxy]propanamide
SMILESCc1nc(COc2ccc(OC(C)C(N)=O)cc2)oc1C
InChIInChI=1S/C15H18N2O4/c1-9-10(2)21-14(17-9)8-19-12-4-6-13(7-5-12)20-11(3)15(16)18/h4-7,11H,8H2,1-3H3,(H2,16,18)
InChIKeyZKTVSOQQPAJLAK-UHFFFAOYSA-N
XLogP2.12
TPSA87.58 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methoxy]phenoxy]propanamide?
The IUPAC name of 2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methoxy]phenoxy]propanamide (CID 71996890) is 2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methoxy]phenoxy]propanamide.
What is the SMILES notation for 2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methoxy]phenoxy]propanamide?
The canonical SMILES for 2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methoxy]phenoxy]propanamide is Cc1nc(COc2ccc(OC(C)C(N)=O)cc2)oc1C.
What is the InChIKey of 2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methoxy]phenoxy]propanamide?
The InChIKey is ZKTVSOQQPAJLAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O4/c1-9-10(2)21-14(17-9)8-19-12-4-6-13(7-5-12)20-11(3)15(16)18/h4-7,11H,8H2,1-3H3,(H2,16,18).
What are the key properties of 2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methoxy]phenoxy]propanamide?
2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methoxy]phenoxy]propanamide has a molecular weight of 290.32 g/mol, XLogP of 2.12, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methoxy]phenoxy]propanamide is sourced from PubChem (CID 71996890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).