2-(3-fluorophenyl)-N-(1,3-oxazol-4-ylmethyl)acetamide

C12H11FN2O2 — CID 110718968

IUPAC2-(3-fluorophenyl)-N-(1,3-oxazol-4-ylmethyl)acetamide
SMILESO=C(Cc1cccc(F)c1)NCc1cocn1
InChIInChI=1S/C12H11FN2O2/c13-10-3-1-2-9(4-10)5-12(16)14-6-11-7-17-8-15-11/h1-4,7-8H,5-6H2,(H,14,16)
InChIKeyQLJBKEUPZAKEQY-UHFFFAOYSA-N
MW234.23 g/mol
LogP1.67
Rot. Bonds4

About 2-(3-fluorophenyl)-N-(1,3-oxazol-4-ylmethyl)acetamide

2-(3-fluorophenyl)-N-(1,3-oxazol-4-ylmethyl)acetamide (PubChem CID 110718968) has the molecular formula C12H11FN2O2 and a molecular weight of 234.23 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N-(1,3-oxazol-4-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N-(1,3-oxazol-4-ylmethyl)acetamide
PubChem CID110718968
Molecular FormulaC12H11FN2O2
Molecular Weight234.23 g/mol
Exact Mass234.08
IUPAC Name2-(3-fluorophenyl)-N-(1,3-oxazol-4-ylmethyl)acetamide
SMILESO=C(Cc1cccc(F)c1)NCc1cocn1
InChIInChI=1S/C12H11FN2O2/c13-10-3-1-2-9(4-10)5-12(16)14-6-11-7-17-8-15-11/h1-4,7-8H,5-6H2,(H,14,16)
InChIKeyQLJBKEUPZAKEQY-UHFFFAOYSA-N
XLogP1.67
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.23
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-fluorophenyl)methyl]-2-(1,3-oxazol-4-yl)acetamide
CID 110686255
N-[(5-acetyl-6-methyl-2-pyridinyl)methyl]-2-(3-fluorophenyl)acetamide
CID 84594591
5-[[[2-(3-fluorophenyl)acetyl]amino]methyl]furan-2-carboxylic acid
CID 84586226
2-(3-fluorophenyl)-N-[(2-piperidin-1-yl-3-pyridinyl)methyl]acetamide
CID 51093862
2-(3-methoxyphenyl)-N-[2-(1,3-oxazol-4-yl)ethyl]acetamide
CID 110722006
2-(3-fluorophenyl)-N-[[2-[(3-fluorophenyl)methoxy]-4-pyridinyl]methyl]acetamide
CID 171787172
2-(4-chlorophenyl)-N-[(3-fluorophenyl)methyl]acetamide
CID 47161047
N-[(3-fluorophenyl)methyl]-2-[5-(4-methylphenyl)-2-pyridinyl]acetamide
CID 163790106
N-[2-(diaminomethylideneamino)ethyl]-2-(3-fluorophenyl)acetamide
CID 119112923
3-(3-fluorophenyl)-N-(1,3-thiazol-4-ylmethyl)propanamide
CID 110717379
N-[[6-[(2R)-1-acetylpyrrolidin-2-yl]pyrazin-2-yl]methyl]-2-(3-fluorophenyl)acetamide
CID 124979320
N-(3-aminopropyl)-2-(3-fluorophenyl)acetamide
CID 24690236

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N-(1,3-oxazol-4-ylmethyl)acetamide?
The IUPAC name of 2-(3-fluorophenyl)-N-(1,3-oxazol-4-ylmethyl)acetamide (CID 110718968) is 2-(3-fluorophenyl)-N-(1,3-oxazol-4-ylmethyl)acetamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N-(1,3-oxazol-4-ylmethyl)acetamide?
The canonical SMILES for 2-(3-fluorophenyl)-N-(1,3-oxazol-4-ylmethyl)acetamide is O=C(Cc1cccc(F)c1)NCc1cocn1.
What is the InChIKey of 2-(3-fluorophenyl)-N-(1,3-oxazol-4-ylmethyl)acetamide?
The InChIKey is QLJBKEUPZAKEQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11FN2O2/c13-10-3-1-2-9(4-10)5-12(16)14-6-11-7-17-8-15-11/h1-4,7-8H,5-6H2,(H,14,16).
What are the key properties of 2-(3-fluorophenyl)-N-(1,3-oxazol-4-ylmethyl)acetamide?
2-(3-fluorophenyl)-N-(1,3-oxazol-4-ylmethyl)acetamide has a molecular weight of 234.23 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N-(1,3-oxazol-4-ylmethyl)acetamide is sourced from PubChem (CID 110718968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).