2-[[3-[(3-fluorophenyl)methoxy]-1,2-oxazol-5-yl]-methylamino]propanamide

C14H16FN3O3 — CID 67668647

IUPAC2-[[3-[(3-fluorophenyl)methoxy]-1,2-oxazol-5-yl]-methylamino]propanamide
SMILESCC(C(N)=O)N(C)c1cc(OCc2cccc(F)c2)no1
InChIInChI=1S/C14H16FN3O3/c1-9(14(16)19)18(2)13-7-12(17-21-13)20-8-10-4-3-5-11(15)6-10/h3-7,9H,8H2,1-2H3,(H2,16,19)
InChIKeyUHMAZFOBHGYVQY-UHFFFAOYSA-N
MW293.30 g/mol
LogP1.70
Rot. Bonds6

About 2-[[3-[(3-fluorophenyl)methoxy]-1,2-oxazol-5-yl]-methylamino]propanamide

2-[[3-[(3-fluorophenyl)methoxy]-1,2-oxazol-5-yl]-methylamino]propanamide (PubChem CID 67668647) has the molecular formula C14H16FN3O3 and a molecular weight of 293.30 g/mol. Its IUPAC name is 2-[[3-[(3-fluorophenyl)methoxy]-1,2-oxazol-5-yl]-methylamino]propanamide.

Molecular Properties

Compound Name2-[[3-[(3-fluorophenyl)methoxy]-1,2-oxazol-5-yl]-methylamino]propanamide
PubChem CID67668647
Molecular FormulaC14H16FN3O3
Molecular Weight293.30 g/mol
Exact Mass293.12
IUPAC Name2-[[3-[(3-fluorophenyl)methoxy]-1,2-oxazol-5-yl]-methylamino]propanamide
SMILESCC(C(N)=O)N(C)c1cc(OCc2cccc(F)c2)no1
InChIInChI=1S/C14H16FN3O3/c1-9(14(16)19)18(2)13-7-12(17-21-13)20-8-10-4-3-5-11(15)6-10/h3-7,9H,8H2,1-2H3,(H2,16,19)
InChIKeyUHMAZFOBHGYVQY-UHFFFAOYSA-N
XLogP1.70
TPSA81.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.30
LogP ≤ 51.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(3-fluorophenoxy)ethyl-methylamino]propanamide
CID 47286834
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CID 58368103
2-[7-[(3-fluorophenyl)methoxy]-1,2,4,5-tetrahydro-3-benzazepin-3-yl]propanamide
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3-[4-[(3-fluorophenyl)methoxy]phenyl]-2,3-dihydroxypropanamide
CID 171869350
3-[(3-fluorophenyl)methoxy]pyridazine
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N-(1-cyclopropylethyl)-6-[(3-fluorophenyl)methoxy]pyridine-3-carboxamide
CID 76736087
(2S)-2-[[4-[(3-fluorophenyl)methoxy]phenyl]methylamino]propanamide;methanesulfonic acid
CID 3038502
2-[1-(3-fluorophenyl)propan-2-ylamino]propanamide
CID 115708042
[(2R)-1-amino-1-oxopropan-2-yl] 2-(3-fluorophenyl)acetate
CID 8590359
2-[3-[(3-fluorophenyl)methoxy]phenyl]acetamide
CID 60604617
methyl 3-[4-[(3-fluorophenyl)methoxy]phenoxy]propanoate
CID 69037597
N-[4-[(3-fluorophenyl)methoxy]phenyl]-N,2,2-trimethylpropanamide
CID 112828000

Frequently Asked Questions

What is the IUPAC name of 2-[[3-[(3-fluorophenyl)methoxy]-1,2-oxazol-5-yl]-methylamino]propanamide?
The IUPAC name of 2-[[3-[(3-fluorophenyl)methoxy]-1,2-oxazol-5-yl]-methylamino]propanamide (CID 67668647) is 2-[[3-[(3-fluorophenyl)methoxy]-1,2-oxazol-5-yl]-methylamino]propanamide.
What is the SMILES notation for 2-[[3-[(3-fluorophenyl)methoxy]-1,2-oxazol-5-yl]-methylamino]propanamide?
The canonical SMILES for 2-[[3-[(3-fluorophenyl)methoxy]-1,2-oxazol-5-yl]-methylamino]propanamide is CC(C(N)=O)N(C)c1cc(OCc2cccc(F)c2)no1.
What is the InChIKey of 2-[[3-[(3-fluorophenyl)methoxy]-1,2-oxazol-5-yl]-methylamino]propanamide?
The InChIKey is UHMAZFOBHGYVQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O3/c1-9(14(16)19)18(2)13-7-12(17-21-13)20-8-10-4-3-5-11(15)6-10/h3-7,9H,8H2,1-2H3,(H2,16,19).
What are the key properties of 2-[[3-[(3-fluorophenyl)methoxy]-1,2-oxazol-5-yl]-methylamino]propanamide?
2-[[3-[(3-fluorophenyl)methoxy]-1,2-oxazol-5-yl]-methylamino]propanamide has a molecular weight of 293.30 g/mol, XLogP of 1.70, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-[(3-fluorophenyl)methoxy]-1,2-oxazol-5-yl]-methylamino]propanamide is sourced from PubChem (CID 67668647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).