N-[[3-(2-fluorophenyl)-1,2-oxazol-5-yl]methyl]-2-(4-propan-2-ylmorpholin-2-yl)acetamide

C19H24FN3O3 — CID 118788523

IUPACN-[[3-(2-fluorophenyl)-1,2-oxazol-5-yl]methyl]-2-(4-propan-2-ylmorpholin-2-yl)acetamide
SMILESCC(C)N1CCOC(CC(=O)NCc2cc(-c3ccccc3F)no2)C1
InChIInChI=1S/C19H24FN3O3/c1-13(2)23-7-8-25-15(12-23)10-19(24)21-11-14-9-18(22-26-14)16-5-3-4-6-17(16)20/h3-6,9,13,15H,7-8,10-12H2,1-2H3,(H,21,24)
InChIKeyCRTRTCWWZQLXJM-UHFFFAOYSA-N
MW361.42 g/mol
LogP2.60
Rot. Bonds6

About N-[[3-(2-fluorophenyl)-1,2-oxazol-5-yl]methyl]-2-(4-propan-2-ylmorpholin-2-yl)acetamide

N-[[3-(2-fluorophenyl)-1,2-oxazol-5-yl]methyl]-2-(4-propan-2-ylmorpholin-2-yl)acetamide (PubChem CID 118788523) has the molecular formula C19H24FN3O3 and a molecular weight of 361.42 g/mol. Its IUPAC name is N-[[3-(2-fluorophenyl)-1,2-oxazol-5-yl]methyl]-2-(4-propan-2-ylmorpholin-2-yl)acetamide.

Molecular Properties

Compound NameN-[[3-(2-fluorophenyl)-1,2-oxazol-5-yl]methyl]-2-(4-propan-2-ylmorpholin-2-yl)acetamide
PubChem CID118788523
Molecular FormulaC19H24FN3O3
Molecular Weight361.42 g/mol
Exact Mass361.18
IUPAC NameN-[[3-(2-fluorophenyl)-1,2-oxazol-5-yl]methyl]-2-(4-propan-2-ylmorpholin-2-yl)acetamide
SMILESCC(C)N1CCOC(CC(=O)NCc2cc(-c3ccccc3F)no2)C1
InChIInChI=1S/C19H24FN3O3/c1-13(2)23-7-8-25-15(12-23)10-19(24)21-11-14-9-18(22-26-14)16-5-3-4-6-17(16)20/h3-6,9,13,15H,7-8,10-12H2,1-2H3,(H,21,24)
InChIKeyCRTRTCWWZQLXJM-UHFFFAOYSA-N
XLogP2.60
TPSA67.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.42
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[3-(2-fluorophenyl)-1,2-oxazol-5-yl]methyl]-2-(4-propan-2-ylmorpholin-2-yl)acetamide?
The IUPAC name of N-[[3-(2-fluorophenyl)-1,2-oxazol-5-yl]methyl]-2-(4-propan-2-ylmorpholin-2-yl)acetamide (CID 118788523) is N-[[3-(2-fluorophenyl)-1,2-oxazol-5-yl]methyl]-2-(4-propan-2-ylmorpholin-2-yl)acetamide.
What is the SMILES notation for N-[[3-(2-fluorophenyl)-1,2-oxazol-5-yl]methyl]-2-(4-propan-2-ylmorpholin-2-yl)acetamide?
The canonical SMILES for N-[[3-(2-fluorophenyl)-1,2-oxazol-5-yl]methyl]-2-(4-propan-2-ylmorpholin-2-yl)acetamide is CC(C)N1CCOC(CC(=O)NCc2cc(-c3ccccc3F)no2)C1.
What is the InChIKey of N-[[3-(2-fluorophenyl)-1,2-oxazol-5-yl]methyl]-2-(4-propan-2-ylmorpholin-2-yl)acetamide?
The InChIKey is CRTRTCWWZQLXJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN3O3/c1-13(2)23-7-8-25-15(12-23)10-19(24)21-11-14-9-18(22-26-14)16-5-3-4-6-17(16)20/h3-6,9,13,15H,7-8,10-12H2,1-2H3,(H,21,24).
What are the key properties of N-[[3-(2-fluorophenyl)-1,2-oxazol-5-yl]methyl]-2-(4-propan-2-ylmorpholin-2-yl)acetamide?
N-[[3-(2-fluorophenyl)-1,2-oxazol-5-yl]methyl]-2-(4-propan-2-ylmorpholin-2-yl)acetamide has a molecular weight of 361.42 g/mol, XLogP of 2.60, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(2-fluorophenyl)-1,2-oxazol-5-yl]methyl]-2-(4-propan-2-ylmorpholin-2-yl)acetamide is sourced from PubChem (CID 118788523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).