N-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide

C17H20N2O2 — CID 3158158

IUPACN-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide
SMILESCN(C(=O)c1cc(-c2ccccc2)on1)C1CCCCC1
InChIInChI=1S/C17H20N2O2/c1-19(14-10-6-3-7-11-14)17(20)15-12-16(21-18-15)13-8-4-2-5-9-13/h2,4-5,8-9,12,14H,3,6-7,10-11H2,1H3
InChIKeyLUJXBYMHABEGOH-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.75
Rot. Bonds3

About N-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide

N-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide (PubChem CID 3158158) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide
PubChem CID3158158
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide
SMILESCN(C(=O)c1cc(-c2ccccc2)on1)C1CCCCC1
InChIInChI=1S/C17H20N2O2/c1-19(14-10-6-3-7-11-14)17(20)15-12-16(21-18-15)13-8-4-2-5-9-13/h2,4-5,8-9,12,14H,3,6-7,10-11H2,1H3
InChIKeyLUJXBYMHABEGOH-UHFFFAOYSA-N
XLogP3.75
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide?
The IUPAC name of N-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide (CID 3158158) is N-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide?
The canonical SMILES for N-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide is CN(C(=O)c1cc(-c2ccccc2)on1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide?
The InChIKey is LUJXBYMHABEGOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-19(14-10-6-3-7-11-14)17(20)15-12-16(21-18-15)13-8-4-2-5-9-13/h2,4-5,8-9,12,14H,3,6-7,10-11H2,1H3.
What are the key properties of N-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide?
N-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 3.75, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-5-phenyl-1,2-oxazole-3-carboxamide is sourced from PubChem (CID 3158158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).