N-cyclohexyl-2-(1,2-oxazol-3-yl)-N-(3,3,3-trifluoropropyl)acetamide

C14H19F3N2O2 — CID 71858989

IUPACN-cyclohexyl-2-(1,2-oxazol-3-yl)-N-(3,3,3-trifluoropropyl)acetamide
SMILESO=C(Cc1ccon1)N(CCC(F)(F)F)C1CCCCC1
InChIInChI=1S/C14H19F3N2O2/c15-14(16,17)7-8-19(12-4-2-1-3-5-12)13(20)10-11-6-9-21-18-11/h6,9,12H,1-5,7-8,10H2
InChIKeyVIAJNEXAVOMRRB-UHFFFAOYSA-N
MW304.31 g/mol
LogP3.33
Rot. Bonds5

About N-cyclohexyl-2-(1,2-oxazol-3-yl)-N-(3,3,3-trifluoropropyl)acetamide

N-cyclohexyl-2-(1,2-oxazol-3-yl)-N-(3,3,3-trifluoropropyl)acetamide (PubChem CID 71858989) has the molecular formula C14H19F3N2O2 and a molecular weight of 304.31 g/mol. Its IUPAC name is N-cyclohexyl-2-(1,2-oxazol-3-yl)-N-(3,3,3-trifluoropropyl)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(1,2-oxazol-3-yl)-N-(3,3,3-trifluoropropyl)acetamide
PubChem CID71858989
Molecular FormulaC14H19F3N2O2
Molecular Weight304.31 g/mol
Exact Mass304.14
IUPAC NameN-cyclohexyl-2-(1,2-oxazol-3-yl)-N-(3,3,3-trifluoropropyl)acetamide
SMILESO=C(Cc1ccon1)N(CCC(F)(F)F)C1CCCCC1
InChIInChI=1S/C14H19F3N2O2/c15-14(16,17)7-8-19(12-4-2-1-3-5-12)13(20)10-11-6-9-21-18-11/h6,9,12H,1-5,7-8,10H2
InChIKeyVIAJNEXAVOMRRB-UHFFFAOYSA-N
XLogP3.33
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.31
LogP ≤ 53.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(1,2-oxazol-3-yl)-N-(3,3,3-trifluoropropyl)acetamide?
The IUPAC name of N-cyclohexyl-2-(1,2-oxazol-3-yl)-N-(3,3,3-trifluoropropyl)acetamide (CID 71858989) is N-cyclohexyl-2-(1,2-oxazol-3-yl)-N-(3,3,3-trifluoropropyl)acetamide.
What is the SMILES notation for N-cyclohexyl-2-(1,2-oxazol-3-yl)-N-(3,3,3-trifluoropropyl)acetamide?
The canonical SMILES for N-cyclohexyl-2-(1,2-oxazol-3-yl)-N-(3,3,3-trifluoropropyl)acetamide is O=C(Cc1ccon1)N(CCC(F)(F)F)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(1,2-oxazol-3-yl)-N-(3,3,3-trifluoropropyl)acetamide?
The InChIKey is VIAJNEXAVOMRRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F3N2O2/c15-14(16,17)7-8-19(12-4-2-1-3-5-12)13(20)10-11-6-9-21-18-11/h6,9,12H,1-5,7-8,10H2.
What are the key properties of N-cyclohexyl-2-(1,2-oxazol-3-yl)-N-(3,3,3-trifluoropropyl)acetamide?
N-cyclohexyl-2-(1,2-oxazol-3-yl)-N-(3,3,3-trifluoropropyl)acetamide has a molecular weight of 304.31 g/mol, XLogP of 3.33, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(1,2-oxazol-3-yl)-N-(3,3,3-trifluoropropyl)acetamide is sourced from PubChem (CID 71858989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).