N-(4-imidazol-1-ylphenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide

C17H13F3N4O2 — CID 37183985

IUPACN-(4-imidazol-1-ylphenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
SMILESO=C(Cn1cccc(C(F)(F)F)c1=O)Nc1ccc(-n2ccnc2)cc1
InChIInChI=1S/C17H13F3N4O2/c18-17(19,20)14-2-1-8-23(16(14)26)10-15(25)22-12-3-5-13(6-4-12)24-9-7-21-11-24/h1-9,11H,10H2,(H,22,25)
InChIKeySMQZBYPMODOVJY-UHFFFAOYSA-N
MW362.31 g/mol
LogP2.69
Rot. Bonds4

About N-(4-imidazol-1-ylphenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide

N-(4-imidazol-1-ylphenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide (PubChem CID 37183985) has the molecular formula C17H13F3N4O2 and a molecular weight of 362.31 g/mol. Its IUPAC name is N-(4-imidazol-1-ylphenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide.

Molecular Properties

Compound NameN-(4-imidazol-1-ylphenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
PubChem CID37183985
Molecular FormulaC17H13F3N4O2
Molecular Weight362.31 g/mol
Exact Mass362.10
IUPAC NameN-(4-imidazol-1-ylphenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
SMILESO=C(Cn1cccc(C(F)(F)F)c1=O)Nc1ccc(-n2ccnc2)cc1
InChIInChI=1S/C17H13F3N4O2/c18-17(19,20)14-2-1-8-23(16(14)26)10-15(25)22-12-3-5-13(6-4-12)24-9-7-21-11-24/h1-9,11H,10H2,(H,22,25)
InChIKeySMQZBYPMODOVJY-UHFFFAOYSA-N
XLogP2.69
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.31
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-chlorophenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 2746340
N-[4-(1H-benzimidazol-2-yl)phenyl]-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 31776002
2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]-N-(1,3-thiazol-2-yl)acetamide
CID 31700678
N-(4-methyl-3-nitrophenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 55530384
N-(1-benzylpyrazol-4-yl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 55947586
2-(4-imidazol-1-ylphenoxy)-N-[2-(trifluoromethyl)phenyl]acetamide
CID 11545014
N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 31936110
N-[6-(2-methoxy-4-methylphenoxy)-3-pyridinyl]-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 55677465
N-(4-imidazol-1-ylphenyl)acetamide
CID 16761727
N-(4-hydroxycyclohexyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide
CID 110884955
2-(4-hydroxyphenyl)-N-(4-imidazol-1-ylphenyl)acetamide
CID 78845003
N-(4-imidazol-1-ylphenyl)-3-pyrazol-1-ylpropanamide
CID 87039583

Frequently Asked Questions

What is the IUPAC name of N-(4-imidazol-1-ylphenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide?
The IUPAC name of N-(4-imidazol-1-ylphenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide (CID 37183985) is N-(4-imidazol-1-ylphenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide.
What is the SMILES notation for N-(4-imidazol-1-ylphenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide?
The canonical SMILES for N-(4-imidazol-1-ylphenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide is O=C(Cn1cccc(C(F)(F)F)c1=O)Nc1ccc(-n2ccnc2)cc1.
What is the InChIKey of N-(4-imidazol-1-ylphenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide?
The InChIKey is SMQZBYPMODOVJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13F3N4O2/c18-17(19,20)14-2-1-8-23(16(14)26)10-15(25)22-12-3-5-13(6-4-12)24-9-7-21-11-24/h1-9,11H,10H2,(H,22,25).
What are the key properties of N-(4-imidazol-1-ylphenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide?
N-(4-imidazol-1-ylphenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide has a molecular weight of 362.31 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-imidazol-1-ylphenyl)-2-[2-oxo-3-(trifluoromethyl)-1-pyridinyl]acetamide is sourced from PubChem (CID 37183985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).