N-[1-cyclopentyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]propanamide

C18H20F3N3O2 — CID 17087952

IUPACN-[1-cyclopentyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]propanamide
SMILESCCC(=O)NC1(C(F)(F)F)N=C(c2ccccc2)N(C2CCCC2)C1=O
InChIInChI=1S/C18H20F3N3O2/c1-2-14(25)22-17(18(19,20)21)16(26)24(13-10-6-7-11-13)15(23-17)12-8-4-3-5-9-12/h3-5,8-9,13H,2,6-7,10-11H2,1H3,(H,22,25)
InChIKeyHGHAUKPAUZPADP-UHFFFAOYSA-N
MW367.37 g/mol
LogP3.00
Rot. Bonds4

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

N-[1-cyclopentyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]propanamide (PubChem CID 17087952) has the molecular formula C18H20F3N3O2 and a molecular weight of 367.37 g/mol. Its IUPAC name is N-[1-cyclopentyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]propanamide.

Molecular Properties

Compound NameN-[1-cyclopentyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]propanamide
PubChem CID17087952
Molecular FormulaC18H20F3N3O2
Molecular Weight367.37 g/mol
Exact Mass367.15
IUPAC NameN-[1-cyclopentyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]propanamide
SMILESCCC(=O)NC1(C(F)(F)F)N=C(c2ccccc2)N(C2CCCC2)C1=O
InChIInChI=1S/C18H20F3N3O2/c1-2-14(25)22-17(18(19,20)21)16(26)24(13-10-6-7-11-13)15(23-17)12-8-4-3-5-9-12/h3-5,8-9,13H,2,6-7,10-11H2,1H3,(H,22,25)
InChIKeyHGHAUKPAUZPADP-UHFFFAOYSA-N
XLogP3.00
TPSA61.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.37
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-cyclopentyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]propanamide?
The IUPAC name of N-[1-cyclopentyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]propanamide (CID 17087952) is N-[1-cyclopentyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]propanamide.
What is the SMILES notation for N-[1-cyclopentyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]propanamide?
The canonical SMILES for N-[1-cyclopentyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]propanamide is CCC(=O)NC1(C(F)(F)F)N=C(c2ccccc2)N(C2CCCC2)C1=O.
What is the InChIKey of N-[1-cyclopentyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]propanamide?
The InChIKey is HGHAUKPAUZPADP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20F3N3O2/c1-2-14(25)22-17(18(19,20)21)16(26)24(13-10-6-7-11-13)15(23-17)12-8-4-3-5-9-12/h3-5,8-9,13H,2,6-7,10-11H2,1H3,(H,22,25).
What are the key properties of N-[1-cyclopentyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]propanamide?
N-[1-cyclopentyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]propanamide has a molecular weight of 367.37 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-cyclopentyl-5-oxo-2-phenyl-4-(trifluoromethyl)imidazol-4-yl]propanamide is sourced from PubChem (CID 17087952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).