2-(2-fluorophenyl)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]ethanol

C20H18FN5O — CID 164609961

IUPAC2-(2-fluorophenyl)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]ethanol
SMILESCc1[nH]nc2ccc(-c3cncc(NC(CO)c4ccccc4F)n3)cc12
InChIInChI=1S/C20H18FN5O/c1-12-15-8-13(6-7-17(15)26-25-12)18-9-22-10-20(23-18)24-19(11-27)14-4-2-3-5-16(14)21/h2-10,19,27H,11H2,1H3,(H,23,24)(H,25,26)
InChIKeyUONPGHSZLLTRMC-UHFFFAOYSA-N
MW363.40 g/mol
LogP3.61
Rot. Bonds5

About 2-(2-fluorophenyl)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]ethanol

2-(2-fluorophenyl)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]ethanol (PubChem CID 164609961) has the molecular formula C20H18FN5O and a molecular weight of 363.40 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]ethanol.

Molecular Properties

Compound Name2-(2-fluorophenyl)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]ethanol
PubChem CID164609961
Molecular FormulaC20H18FN5O
Molecular Weight363.40 g/mol
Exact Mass363.15
IUPAC Name2-(2-fluorophenyl)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]ethanol
SMILESCc1[nH]nc2ccc(-c3cncc(NC(CO)c4ccccc4F)n3)cc12
InChIInChI=1S/C20H18FN5O/c1-12-15-8-13(6-7-17(15)26-25-12)18-9-22-10-20(23-18)24-19(11-27)14-4-2-3-5-16(14)21/h2-10,19,27H,11H2,1H3,(H,23,24)(H,25,26)
InChIKeyUONPGHSZLLTRMC-UHFFFAOYSA-N
XLogP3.61
TPSA86.72 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.40
LogP ≤ 53.61
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 2-(2-fluorophenyl)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]ethanol with MolForge

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Related Compounds

6-[5-(2,6-difluorophenyl)-1H-indazol-3-yl]-N-piperidin-4-ylpyrazin-2-amine
CID 67959617
1-[6-[5-(2,6-difluorophenyl)-1H-indazol-3-yl]pyrazin-2-yl]piperidin-4-amine
CID 67959736
Cdk8-IN-4
CID 75202254
2-({4-[3-(4-fluorophenyl)-1H-pyrrolo[3,2-b]pyridin-2-yl]pyridin-2-yl}amino)propan-1-ol
CID 11068448
5-(1H-indazol-5-yl)-3-(4-methyl-1,4-diazepan-1-yl)pyrazin-2-amine
CID 11560302
4-[[4-(1H-indazol-3-yl)pyrimidin-2-yl]amino]cyclohexan-1-ol
CID 24960635
4-(3-(4-(4-fluorophenyl)-5-(1H-indazol-5-yl)-1H-imidazol-1-yl)propyl)morpholine
CID 25165280
4-(2-(4-(4-fluorophenyl)-5-(1H-indazol-5-yl)-1H-imidazol-1-yl)ethyl)morpholine
CID 25165481
2-[[2-[(1S)-1-amino-2-(3-fluorophenyl)ethyl]-6-(1H-pyrazol-4-yl)quinazolin-4-yl]-methylamino]ethanol
CID 46207055
N-(azetidin-3-yl)-6-[5-(2,6-difluorophenyl)-1H-indazol-3-yl]pyrazin-2-amine
CID 67959771
1-[6-[5-(2,6-difluorophenyl)-1H-indazol-3-yl]pyrazin-2-yl]piperidin-4-ol
CID 67959841
5-(2,6-difluorophenyl)-3-(6-piperazin-1-ylpyrazin-2-yl)-1H-indazole
CID 67959845

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]ethanol?
The IUPAC name of 2-(2-fluorophenyl)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]ethanol (CID 164609961) is 2-(2-fluorophenyl)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]ethanol.
What is the SMILES notation for 2-(2-fluorophenyl)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]ethanol?
The canonical SMILES for 2-(2-fluorophenyl)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]ethanol is Cc1[nH]nc2ccc(-c3cncc(NC(CO)c4ccccc4F)n3)cc12.
What is the InChIKey of 2-(2-fluorophenyl)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]ethanol?
The InChIKey is UONPGHSZLLTRMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN5O/c1-12-15-8-13(6-7-17(15)26-25-12)18-9-22-10-20(23-18)24-19(11-27)14-4-2-3-5-16(14)21/h2-10,19,27H,11H2,1H3,(H,23,24)(H,25,26).
What are the key properties of 2-(2-fluorophenyl)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]ethanol?
2-(2-fluorophenyl)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]ethanol has a molecular weight of 363.40 g/mol, XLogP of 3.61, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-2-[[6-(3-methyl-2H-indazol-5-yl)pyrazin-2-yl]amino]ethanol is sourced from PubChem (CID 164609961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).