2-[3-[3-(trifluoromethyl)anilino]imidazo[1,2-a]pyrazin-2-yl]phenol

C19H13F3N4O — CID 135620750

IUPAC2-[3-[3-(trifluoromethyl)anilino]imidazo[1,2-a]pyrazin-2-yl]phenol
SMILESOc1ccccc1-c1nc2cnccn2c1Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C19H13F3N4O/c20-19(21,22)12-4-3-5-13(10-12)24-18-17(14-6-1-2-7-15(14)27)25-16-11-23-8-9-26(16)18/h1-11,24,27H
InChIKeyAWIXCAWRUKJRGK-UHFFFAOYSA-N
MW370.33 g/mol
LogP4.86
Rot. Bonds3

About 2-[3-[3-(trifluoromethyl)anilino]imidazo[1,2-a]pyrazin-2-yl]phenol

2-[3-[3-(trifluoromethyl)anilino]imidazo[1,2-a]pyrazin-2-yl]phenol (PubChem CID 135620750) has the molecular formula C19H13F3N4O and a molecular weight of 370.33 g/mol. Its IUPAC name is 2-[3-[3-(trifluoromethyl)anilino]imidazo[1,2-a]pyrazin-2-yl]phenol.

Molecular Properties

Compound Name2-[3-[3-(trifluoromethyl)anilino]imidazo[1,2-a]pyrazin-2-yl]phenol
PubChem CID135620750
Molecular FormulaC19H13F3N4O
Molecular Weight370.33 g/mol
Exact Mass370.10
IUPAC Name2-[3-[3-(trifluoromethyl)anilino]imidazo[1,2-a]pyrazin-2-yl]phenol
SMILESOc1ccccc1-c1nc2cnccn2c1Nc1cccc(C(F)(F)F)c1
InChIInChI=1S/C19H13F3N4O/c20-19(21,22)12-4-3-5-13(10-12)24-18-17(14-6-1-2-7-15(14)27)25-16-11-23-8-9-26(16)18/h1-11,24,27H
InChIKeyAWIXCAWRUKJRGK-UHFFFAOYSA-N
XLogP4.86
TPSA62.45 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.33
LogP ≤ 54.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

Sb-202190
CID 5169
3-(2-Hydroxyphenyl)-9h-Pyrrolo[2,3-B:5,4-C']dipyridine-6-Carbonitrile
CID 44546231
4-{5H-pyrrolo[2,3-b]pyrazin-6-yl}phenol
CID 135433406
2-(3-Benzylimidazol-4-yl)phenol
CID 2806275
2-(((1-(2-(piperidin-1-yl)ethyl)-1H-benzo[d]imidazol-2-yl)amino)methyl)phenol
CID 1090110
4-{2-amino-1-methyl-1H-imidazo[4,5-b]pyridin-6-yl}phenol
CID 15897928
Antiproliferative agent-14
CID 86280647
3-{5H-pyrrolo[2,3-b]pyrazin-6-yl}phenol
CID 6538769
6-phenyl[5H]pyrrolo[2,3-b]pyrazine (aloisine) 11
CID 135434951
2-[3-(7-Amino-2-phenylpyrazolo[4,3-d]pyrimidin-5-yl)propyl]phenol
CID 118708238
2-{3-[(2,6-Dimethylphenyl)amino]imidazo[1,2-a]pyrimidin-2-yl}phenol
CID 15990343
4-Imidazo[1,2-a]pyridin-2-yl-phenol
CID 16682232

Frequently Asked Questions

What is the IUPAC name of 2-[3-[3-(trifluoromethyl)anilino]imidazo[1,2-a]pyrazin-2-yl]phenol?
The IUPAC name of 2-[3-[3-(trifluoromethyl)anilino]imidazo[1,2-a]pyrazin-2-yl]phenol (CID 135620750) is 2-[3-[3-(trifluoromethyl)anilino]imidazo[1,2-a]pyrazin-2-yl]phenol.
What is the SMILES notation for 2-[3-[3-(trifluoromethyl)anilino]imidazo[1,2-a]pyrazin-2-yl]phenol?
The canonical SMILES for 2-[3-[3-(trifluoromethyl)anilino]imidazo[1,2-a]pyrazin-2-yl]phenol is Oc1ccccc1-c1nc2cnccn2c1Nc1cccc(C(F)(F)F)c1.
What is the InChIKey of 2-[3-[3-(trifluoromethyl)anilino]imidazo[1,2-a]pyrazin-2-yl]phenol?
The InChIKey is AWIXCAWRUKJRGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13F3N4O/c20-19(21,22)12-4-3-5-13(10-12)24-18-17(14-6-1-2-7-15(14)27)25-16-11-23-8-9-26(16)18/h1-11,24,27H.
What are the key properties of 2-[3-[3-(trifluoromethyl)anilino]imidazo[1,2-a]pyrazin-2-yl]phenol?
2-[3-[3-(trifluoromethyl)anilino]imidazo[1,2-a]pyrazin-2-yl]phenol has a molecular weight of 370.33 g/mol, XLogP of 4.86, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[3-(trifluoromethyl)anilino]imidazo[1,2-a]pyrazin-2-yl]phenol is sourced from PubChem (CID 135620750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).