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

C14H13FN2O2 — CID 16866842

IUPACN-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide
SMILESO=C(NCc1cc(-c2ccc(F)cc2)on1)C1CC1
InChIInChI=1S/C14H13FN2O2/c15-11-5-3-9(4-6-11)13-7-12(17-19-13)8-16-14(18)10-1-2-10/h3-7,10H,1-2,8H2,(H,16,18)
InChIKeyKFMUOCQKLQCAQJ-UHFFFAOYSA-N
MW260.27 g/mol
LogP2.51
Rot. Bonds4

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

N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide (PubChem CID 16866842) has the molecular formula C14H13FN2O2 and a molecular weight of 260.27 g/mol. Its IUPAC name is N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide
PubChem CID16866842
Molecular FormulaC14H13FN2O2
Molecular Weight260.27 g/mol
Exact Mass260.10
IUPAC NameN-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide
SMILESO=C(NCc1cc(-c2ccc(F)cc2)on1)C1CC1
InChIInChI=1S/C14H13FN2O2/c15-11-5-3-9(4-6-11)13-7-12(17-19-13)8-16-14(18)10-1-2-10/h3-7,10H,1-2,8H2,(H,16,18)
InChIKeyKFMUOCQKLQCAQJ-UHFFFAOYSA-N
XLogP2.51
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.27
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide?
The IUPAC name of N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide (CID 16866842) is N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide?
The canonical SMILES for N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide is O=C(NCc1cc(-c2ccc(F)cc2)on1)C1CC1.
What is the InChIKey of N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide?
The InChIKey is KFMUOCQKLQCAQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O2/c15-11-5-3-9(4-6-11)13-7-12(17-19-13)8-16-14(18)10-1-2-10/h3-7,10H,1-2,8H2,(H,16,18).
What are the key properties of N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide?
N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide has a molecular weight of 260.27 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(4-fluorophenyl)-1,2-oxazol-3-yl]methyl]cyclopropanecarboxamide is sourced from PubChem (CID 16866842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).