N-[1-cyclohexyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]-4-methylbenzamide

C24H24F3N3O2 — CID 15987548

IUPACN-[1-cyclohexyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]-4-methylbenzamide
SMILESCc1ccc(C(=O)NC2(C(F)(F)F)N=C(c3ccccc3)N(C3CCCCC3)C2=O)cc1
InChIInChI=1S/C24H24F3N3O2/c1-16-12-14-18(15-13-16)21(31)29-23(24(25,26)27)22(32)30(19-10-6-3-7-11-19)20(28-23)17-8-4-2-5-9-17/h2,4-5,8-9,12-15,19H,3,6-7,10-11H2,1H3,(H,29,31)
InChIKeySFBOZNPJZNZJQL-UHFFFAOYSA-N
MW443.47 g/mol
LogP4.61
Rot. Bonds4

About N-[1-cyclohexyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]-4-methylbenzamide

N-[1-cyclohexyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]-4-methylbenzamide (PubChem CID 15987548) has the molecular formula C24H24F3N3O2 and a molecular weight of 443.47 g/mol. Its IUPAC name is N-[1-cyclohexyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]-4-methylbenzamide.

Molecular Properties

Compound NameN-[1-cyclohexyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]-4-methylbenzamide
PubChem CID15987548
Molecular FormulaC24H24F3N3O2
Molecular Weight443.47 g/mol
Exact Mass443.18
IUPAC NameN-[1-cyclohexyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]-4-methylbenzamide
SMILESCc1ccc(C(=O)NC2(C(F)(F)F)N=C(c3ccccc3)N(C3CCCCC3)C2=O)cc1
InChIInChI=1S/C24H24F3N3O2/c1-16-12-14-18(15-13-16)21(31)29-23(24(25,26)27)22(32)30(19-10-6-3-7-11-19)20(28-23)17-8-4-2-5-9-17/h2,4-5,8-9,12-15,19H,3,6-7,10-11H2,1H3,(H,29,31)
InChIKeySFBOZNPJZNZJQL-UHFFFAOYSA-N
XLogP4.61
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.47
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-cyclohexyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]-4-methylbenzamide?
The IUPAC name of N-[1-cyclohexyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]-4-methylbenzamide (CID 15987548) is N-[1-cyclohexyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]-4-methylbenzamide.
What is the SMILES notation for N-[1-cyclohexyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]-4-methylbenzamide?
The canonical SMILES for N-[1-cyclohexyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]-4-methylbenzamide is Cc1ccc(C(=O)NC2(C(F)(F)F)N=C(c3ccccc3)N(C3CCCCC3)C2=O)cc1.
What is the InChIKey of N-[1-cyclohexyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]-4-methylbenzamide?
The InChIKey is SFBOZNPJZNZJQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24F3N3O2/c1-16-12-14-18(15-13-16)21(31)29-23(24(25,26)27)22(32)30(19-10-6-3-7-11-19)20(28-23)17-8-4-2-5-9-17/h2,4-5,8-9,12-15,19H,3,6-7,10-11H2,1H3,(H,29,31).
What are the key properties of N-[1-cyclohexyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]-4-methylbenzamide?
N-[1-cyclohexyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]-4-methylbenzamide has a molecular weight of 443.47 g/mol, XLogP of 4.61, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-cyclohexyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]-4-methylbenzamide is sourced from PubChem (CID 15987548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).