1-fluoro-N-(1,3-oxazol-5-yl)-N-phenylcyclohexane-1-carboxamide

C16H17FN2O2 — CID 118010896

IUPAC1-fluoro-N-(1,3-oxazol-5-yl)-N-phenylcyclohexane-1-carboxamide
SMILESO=C(N(c1ccccc1)c1cnco1)C1(F)CCCCC1
InChIInChI=1S/C16H17FN2O2/c17-16(9-5-2-6-10-16)15(20)19(14-11-18-12-21-14)13-7-3-1-4-8-13/h1,3-4,7-8,11-12H,2,5-6,9-10H2
InChIKeyFGMWBQLGLREICE-UHFFFAOYSA-N
MW288.32 g/mol
LogP4.01
Rot. Bonds3

About 1-fluoro-N-(1,3-oxazol-5-yl)-N-phenylcyclohexane-1-carboxamide

1-fluoro-N-(1,3-oxazol-5-yl)-N-phenylcyclohexane-1-carboxamide (PubChem CID 118010896) has the molecular formula C16H17FN2O2 and a molecular weight of 288.32 g/mol. Its IUPAC name is 1-fluoro-N-(1,3-oxazol-5-yl)-N-phenylcyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-fluoro-N-(1,3-oxazol-5-yl)-N-phenylcyclohexane-1-carboxamide
PubChem CID118010896
Molecular FormulaC16H17FN2O2
Molecular Weight288.32 g/mol
Exact Mass288.13
IUPAC Name1-fluoro-N-(1,3-oxazol-5-yl)-N-phenylcyclohexane-1-carboxamide
SMILESO=C(N(c1ccccc1)c1cnco1)C1(F)CCCCC1
InChIInChI=1S/C16H17FN2O2/c17-16(9-5-2-6-10-16)15(20)19(14-11-18-12-21-14)13-7-3-1-4-8-13/h1,3-4,7-8,11-12H,2,5-6,9-10H2
InChIKeyFGMWBQLGLREICE-UHFFFAOYSA-N
XLogP4.01
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.32
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-fluoro-N-(1,3-oxazol-5-yl)-N-phenylcyclohexane-1-carboxamide?
The IUPAC name of 1-fluoro-N-(1,3-oxazol-5-yl)-N-phenylcyclohexane-1-carboxamide (CID 118010896) is 1-fluoro-N-(1,3-oxazol-5-yl)-N-phenylcyclohexane-1-carboxamide.
What is the SMILES notation for 1-fluoro-N-(1,3-oxazol-5-yl)-N-phenylcyclohexane-1-carboxamide?
The canonical SMILES for 1-fluoro-N-(1,3-oxazol-5-yl)-N-phenylcyclohexane-1-carboxamide is O=C(N(c1ccccc1)c1cnco1)C1(F)CCCCC1.
What is the InChIKey of 1-fluoro-N-(1,3-oxazol-5-yl)-N-phenylcyclohexane-1-carboxamide?
The InChIKey is FGMWBQLGLREICE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FN2O2/c17-16(9-5-2-6-10-16)15(20)19(14-11-18-12-21-14)13-7-3-1-4-8-13/h1,3-4,7-8,11-12H,2,5-6,9-10H2.
What are the key properties of 1-fluoro-N-(1,3-oxazol-5-yl)-N-phenylcyclohexane-1-carboxamide?
1-fluoro-N-(1,3-oxazol-5-yl)-N-phenylcyclohexane-1-carboxamide has a molecular weight of 288.32 g/mol, XLogP of 4.01, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-N-(1,3-oxazol-5-yl)-N-phenylcyclohexane-1-carboxamide is sourced from PubChem (CID 118010896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).