4-(4-fluorophenyl)-N-(1,2-oxazol-5-yl)piperazine-1-carboxamide

C14H15FN4O2 — CID 108814011

IUPAC4-(4-fluorophenyl)-N-(1,2-oxazol-5-yl)piperazine-1-carboxamide
SMILESO=C(Nc1ccno1)N1CCN(c2ccc(F)cc2)CC1
InChIInChI=1S/C14H15FN4O2/c15-11-1-3-12(4-2-11)18-7-9-19(10-8-18)14(20)17-13-5-6-16-21-13/h1-6H,7-10H2,(H,17,20)
InChIKeyKZLDVUXRFHZUEY-UHFFFAOYSA-N
MW290.30 g/mol
LogP2.17
Rot. Bonds2

About 4-(4-fluorophenyl)-N-(1,2-oxazol-5-yl)piperazine-1-carboxamide

4-(4-fluorophenyl)-N-(1,2-oxazol-5-yl)piperazine-1-carboxamide (PubChem CID 108814011) has the molecular formula C14H15FN4O2 and a molecular weight of 290.30 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-N-(1,2-oxazol-5-yl)piperazine-1-carboxamide.

Molecular Properties

Compound Name4-(4-fluorophenyl)-N-(1,2-oxazol-5-yl)piperazine-1-carboxamide
PubChem CID108814011
Molecular FormulaC14H15FN4O2
Molecular Weight290.30 g/mol
Exact Mass290.12
IUPAC Name4-(4-fluorophenyl)-N-(1,2-oxazol-5-yl)piperazine-1-carboxamide
SMILESO=C(Nc1ccno1)N1CCN(c2ccc(F)cc2)CC1
InChIInChI=1S/C14H15FN4O2/c15-11-1-3-12(4-2-11)18-7-9-19(10-8-18)14(20)17-13-5-6-16-21-13/h1-6H,7-10H2,(H,17,20)
InChIKeyKZLDVUXRFHZUEY-UHFFFAOYSA-N
XLogP2.17
TPSA61.61 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.30
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-N-(1,2-oxazol-5-yl)piperazine-1-carboxamide?
The IUPAC name of 4-(4-fluorophenyl)-N-(1,2-oxazol-5-yl)piperazine-1-carboxamide (CID 108814011) is 4-(4-fluorophenyl)-N-(1,2-oxazol-5-yl)piperazine-1-carboxamide.
What is the SMILES notation for 4-(4-fluorophenyl)-N-(1,2-oxazol-5-yl)piperazine-1-carboxamide?
The canonical SMILES for 4-(4-fluorophenyl)-N-(1,2-oxazol-5-yl)piperazine-1-carboxamide is O=C(Nc1ccno1)N1CCN(c2ccc(F)cc2)CC1.
What is the InChIKey of 4-(4-fluorophenyl)-N-(1,2-oxazol-5-yl)piperazine-1-carboxamide?
The InChIKey is KZLDVUXRFHZUEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN4O2/c15-11-1-3-12(4-2-11)18-7-9-19(10-8-18)14(20)17-13-5-6-16-21-13/h1-6H,7-10H2,(H,17,20).
What are the key properties of 4-(4-fluorophenyl)-N-(1,2-oxazol-5-yl)piperazine-1-carboxamide?
4-(4-fluorophenyl)-N-(1,2-oxazol-5-yl)piperazine-1-carboxamide has a molecular weight of 290.30 g/mol, XLogP of 2.17, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-fluorophenyl)-N-(1,2-oxazol-5-yl)piperazine-1-carboxamide is sourced from PubChem (CID 108814011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).