2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol

C8H12F2N4O — CID 107495031

IUPAC2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol
SMILESNc1cnc(N(CCO)CC(F)F)cn1
InChIInChI=1S/C8H12F2N4O/c9-6(10)5-14(1-2-15)8-4-12-7(11)3-13-8/h3-4,6,15H,1-2,5H2,(H2,11,12)
InChIKeyVVGWTTBAFGFADW-UHFFFAOYSA-N
MW218.21 g/mol
LogP0.12
Rot. Bonds5

About 2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol

2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol (PubChem CID 107495031) has the molecular formula C8H12F2N4O and a molecular weight of 218.21 g/mol. Its IUPAC name is 2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol.

Molecular Properties

Compound Name2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol
PubChem CID107495031
Molecular FormulaC8H12F2N4O
Molecular Weight218.21 g/mol
Exact Mass218.10
IUPAC Name2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol
SMILESNc1cnc(N(CCO)CC(F)F)cn1
InChIInChI=1S/C8H12F2N4O/c9-6(10)5-14(1-2-15)8-4-12-7(11)3-13-8/h3-4,6,15H,1-2,5H2,(H2,11,12)
InChIKeyVVGWTTBAFGFADW-UHFFFAOYSA-N
XLogP0.12
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.21
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[[5-(aminomethyl)pyrazin-2-yl]-(2,2-difluoroethyl)amino]ethanol
CID 107478418
5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyrazine-2-carbonitrile
CID 107479570
2-[2,2-difluoroethyl-[5-(hydroxymethyl)-2-pyridinyl]amino]ethanol
CID 107481030
2-amino-5-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyridine-4-carboxamide
CID 114195454
2-[(5-chloropyrimidin-2-yl)-(2,2-difluoroethyl)amino]ethanol
CID 107484163
2-[(5-amino-3-methyl-2-pyridinyl)-(2,2-difluoroethyl)amino]ethanol
CID 107478248
2-[[4-(aminomethyl)pyrimidin-2-yl]-(2,2-difluoroethyl)amino]ethanol
CID 107542342
2-[(5-amino-6-methoxy-2-pyridinyl)-(2,2-difluoroethyl)amino]ethanol
CID 107478117
6-[2,2-difluoroethyl(2-hydroxyethyl)amino]pyrazine-2-carboxylic acid
CID 107480405
2-[[3-(aminomethyl)-2-pyridinyl]-(2,2-difluoroethyl)amino]ethanol
CID 107478427
2-[(6-amino-5-propan-2-ylpyrimidin-4-yl)-(2,2-difluoroethyl)amino]ethanol
CID 107495177
5-[(5-aminopyrazin-2-yl)-methylamino]pentan-1-ol
CID 107207397

Frequently Asked Questions

What is the IUPAC name of 2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol?
The IUPAC name of 2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol (CID 107495031) is 2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol.
What is the SMILES notation for 2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol?
The canonical SMILES for 2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol is Nc1cnc(N(CCO)CC(F)F)cn1.
What is the InChIKey of 2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol?
The InChIKey is VVGWTTBAFGFADW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F2N4O/c9-6(10)5-14(1-2-15)8-4-12-7(11)3-13-8/h3-4,6,15H,1-2,5H2,(H2,11,12).
What are the key properties of 2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol?
2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol has a molecular weight of 218.21 g/mol, XLogP of 0.12, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-aminopyrazin-2-yl)-(2,2-difluoroethyl)amino]ethanol is sourced from PubChem (CID 107495031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).