2-(2,3-dihydroimidazo[1,2-a]imidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide

C15H15F3N4O — CID 154779267

IUPAC2-(2,3-dihydroimidazo[1,2-a]imidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
SMILESCC(C(=O)Nc1cccc(C(F)(F)F)c1)N1CCn2ccnc21
InChIInChI=1S/C15H15F3N4O/c1-10(22-8-7-21-6-5-19-14(21)22)13(23)20-12-4-2-3-11(9-12)15(16,17)18/h2-6,9-10H,7-8H2,1H3,(H,20,23)
InChIKeyZHQZUYDRRQAGDB-UHFFFAOYSA-N
MW324.31 g/mol
LogP2.75
Rot. Bonds3

About 2-(2,3-dihydroimidazo[1,2-a]imidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide

2-(2,3-dihydroimidazo[1,2-a]imidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide (PubChem CID 154779267) has the molecular formula C15H15F3N4O and a molecular weight of 324.31 g/mol. Its IUPAC name is 2-(2,3-dihydroimidazo[1,2-a]imidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide.

Molecular Properties

Compound Name2-(2,3-dihydroimidazo[1,2-a]imidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
PubChem CID154779267
Molecular FormulaC15H15F3N4O
Molecular Weight324.31 g/mol
Exact Mass324.12
IUPAC Name2-(2,3-dihydroimidazo[1,2-a]imidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
SMILESCC(C(=O)Nc1cccc(C(F)(F)F)c1)N1CCn2ccnc21
InChIInChI=1S/C15H15F3N4O/c1-10(22-8-7-21-6-5-19-14(21)22)13(23)20-12-4-2-3-11(9-12)15(16,17)18/h2-6,9-10H,7-8H2,1H3,(H,20,23)
InChIKeyZHQZUYDRRQAGDB-UHFFFAOYSA-N
XLogP2.75
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.31
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(6-oxo-3-pyrazol-1-ylpyridazin-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
CID 90517531
2-[4-(2-hydroxyphenyl)piperazin-1-yl]-N-[3-(trifluoromethyl)phenyl]propanamide
CID 78698744
2-methyl-3-sulfanyl-N-[3-(trifluoromethyl)phenyl]butanamide
CID 167244697
(2S)-2-amino-3-methyl-N-[3-(trifluoromethyl)phenyl]butanamide
CID 22690700
2-(4-nitropyrazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
CID 4915850
2-acetamido-N-[3-(trifluoromethyl)phenyl]propanamide
CID 78776683
3-(ethylamino)-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide
CID 62853406
2-[4-(morpholine-4-carbonyl)piperidin-1-yl]-N-[3-(trifluoromethyl)phenyl]propanamide
CID 42889908
2-(4-oxo-1,2,3-benzotriazin-3-yl)-N-[3-(trifluoromethyl)phenyl]propanamide
CID 4905448
(2S)-2-[4-[(3S)-1,1-dioxothiolan-3-yl]piperazin-1-yl]-N-[3-(trifluoromethyl)phenyl]propanamide
CID 30958520
[1-oxo-1-[3-(trifluoromethyl)anilino]propan-2-yl] cyclopentanecarboxylate
CID 42900734
2-hydroxy-2-methyl-N-[3-(trifluoromethyl)phenyl]propanamide
CID 71371552

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydroimidazo[1,2-a]imidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide?
The IUPAC name of 2-(2,3-dihydroimidazo[1,2-a]imidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide (CID 154779267) is 2-(2,3-dihydroimidazo[1,2-a]imidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide.
What is the SMILES notation for 2-(2,3-dihydroimidazo[1,2-a]imidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide?
The canonical SMILES for 2-(2,3-dihydroimidazo[1,2-a]imidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide is CC(C(=O)Nc1cccc(C(F)(F)F)c1)N1CCn2ccnc21.
What is the InChIKey of 2-(2,3-dihydroimidazo[1,2-a]imidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide?
The InChIKey is ZHQZUYDRRQAGDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15F3N4O/c1-10(22-8-7-21-6-5-19-14(21)22)13(23)20-12-4-2-3-11(9-12)15(16,17)18/h2-6,9-10H,7-8H2,1H3,(H,20,23).
What are the key properties of 2-(2,3-dihydroimidazo[1,2-a]imidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide?
2-(2,3-dihydroimidazo[1,2-a]imidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide has a molecular weight of 324.31 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydroimidazo[1,2-a]imidazol-1-yl)-N-[3-(trifluoromethyl)phenyl]propanamide is sourced from PubChem (CID 154779267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).