2-fluoro-7-hydroxy-2-methyl-5-(1,3-oxazol-2-yl)-9-phenylnonanamide

C19H25FN2O3 — CID 23439299

IUPAC2-fluoro-7-hydroxy-2-methyl-5-(1,3-oxazol-2-yl)-9-phenylnonanamide
SMILESCC(F)(CCC(CC(O)CCc1ccccc1)c1ncco1)C(N)=O
InChIInChI=1S/C19H25FN2O3/c1-19(20,18(21)24)10-9-15(17-22-11-12-25-17)13-16(23)8-7-14-5-3-2-4-6-14/h2-6,11-12,15-16,23H,7-10,13H2,1H3,(H2,21,24)
InChIKeyDYFDQISRVQRKDJ-UHFFFAOYSA-N
MW348.42 g/mol
LogP3.14
Rot. Bonds10

About 2-fluoro-7-hydroxy-2-methyl-5-(1,3-oxazol-2-yl)-9-phenylnonanamide

2-fluoro-7-hydroxy-2-methyl-5-(1,3-oxazol-2-yl)-9-phenylnonanamide (PubChem CID 23439299) has the molecular formula C19H25FN2O3 and a molecular weight of 348.42 g/mol. Its IUPAC name is 2-fluoro-7-hydroxy-2-methyl-5-(1,3-oxazol-2-yl)-9-phenylnonanamide.

Molecular Properties

Compound Name2-fluoro-7-hydroxy-2-methyl-5-(1,3-oxazol-2-yl)-9-phenylnonanamide
PubChem CID23439299
Molecular FormulaC19H25FN2O3
Molecular Weight348.42 g/mol
Exact Mass348.18
IUPAC Name2-fluoro-7-hydroxy-2-methyl-5-(1,3-oxazol-2-yl)-9-phenylnonanamide
SMILESCC(F)(CCC(CC(O)CCc1ccccc1)c1ncco1)C(N)=O
InChIInChI=1S/C19H25FN2O3/c1-19(20,18(21)24)10-9-15(17-22-11-12-25-17)13-16(23)8-7-14-5-3-2-4-6-14/h2-6,11-12,15-16,23H,7-10,13H2,1H3,(H2,21,24)
InChIKeyDYFDQISRVQRKDJ-UHFFFAOYSA-N
XLogP3.14
TPSA89.35 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 53.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-7-hydroxy-2-methyl-5-(1,3-oxazol-2-yl)-9-phenylnonanamide?
The IUPAC name of 2-fluoro-7-hydroxy-2-methyl-5-(1,3-oxazol-2-yl)-9-phenylnonanamide (CID 23439299) is 2-fluoro-7-hydroxy-2-methyl-5-(1,3-oxazol-2-yl)-9-phenylnonanamide.
What is the SMILES notation for 2-fluoro-7-hydroxy-2-methyl-5-(1,3-oxazol-2-yl)-9-phenylnonanamide?
The canonical SMILES for 2-fluoro-7-hydroxy-2-methyl-5-(1,3-oxazol-2-yl)-9-phenylnonanamide is CC(F)(CCC(CC(O)CCc1ccccc1)c1ncco1)C(N)=O.
What is the InChIKey of 2-fluoro-7-hydroxy-2-methyl-5-(1,3-oxazol-2-yl)-9-phenylnonanamide?
The InChIKey is DYFDQISRVQRKDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25FN2O3/c1-19(20,18(21)24)10-9-15(17-22-11-12-25-17)13-16(23)8-7-14-5-3-2-4-6-14/h2-6,11-12,15-16,23H,7-10,13H2,1H3,(H2,21,24).
What are the key properties of 2-fluoro-7-hydroxy-2-methyl-5-(1,3-oxazol-2-yl)-9-phenylnonanamide?
2-fluoro-7-hydroxy-2-methyl-5-(1,3-oxazol-2-yl)-9-phenylnonanamide has a molecular weight of 348.42 g/mol, XLogP of 3.14, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-7-hydroxy-2-methyl-5-(1,3-oxazol-2-yl)-9-phenylnonanamide is sourced from PubChem (CID 23439299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).