2-[7-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]imidazo[1,2-b][1,2,4]triazin-3-yl]propan-2-ol

C19H15F2N5O — CID 10133554

IUPAC2-[7-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]imidazo[1,2-b][1,2,4]triazin-3-yl]propan-2-ol
SMILESCC(C)(O)c1cnn2c(-c3ccc(F)c(-c4ncccc4F)c3)cnc2n1
InChIInChI=1S/C19H15F2N5O/c1-19(2,27)16-10-24-26-15(9-23-18(26)25-16)11-5-6-13(20)12(8-11)17-14(21)4-3-7-22-17/h3-10,27H,1-2H3
InChIKeyWIACWFSVQJVNGF-UHFFFAOYSA-N
MW367.36 g/mol
LogP3.36
Rot. Bonds3

About 2-[7-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]imidazo[1,2-b][1,2,4]triazin-3-yl]propan-2-ol

2-[7-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]imidazo[1,2-b][1,2,4]triazin-3-yl]propan-2-ol (PubChem CID 10133554) has the molecular formula C19H15F2N5O and a molecular weight of 367.36 g/mol. Its IUPAC name is 2-[7-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]imidazo[1,2-b][1,2,4]triazin-3-yl]propan-2-ol.

Molecular Properties

Compound Name2-[7-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]imidazo[1,2-b][1,2,4]triazin-3-yl]propan-2-ol
PubChem CID10133554
Molecular FormulaC19H15F2N5O
Molecular Weight367.36 g/mol
Exact Mass367.12
IUPAC Name2-[7-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]imidazo[1,2-b][1,2,4]triazin-3-yl]propan-2-ol
SMILESCC(C)(O)c1cnn2c(-c3ccc(F)c(-c4ncccc4F)c3)cnc2n1
InChIInChI=1S/C19H15F2N5O/c1-19(2,27)16-10-24-26-15(9-23-18(26)25-16)11-5-6-13(20)12(8-11)17-14(21)4-3-7-22-17/h3-10,27H,1-2H3
InChIKeyWIACWFSVQJVNGF-UHFFFAOYSA-N
XLogP3.36
TPSA76.20 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.36
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[7-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]imidazo[1,2-b][1,2,4]triazin-3-yl]propan-2-ol?
The IUPAC name of 2-[7-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]imidazo[1,2-b][1,2,4]triazin-3-yl]propan-2-ol (CID 10133554) is 2-[7-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]imidazo[1,2-b][1,2,4]triazin-3-yl]propan-2-ol.
What is the SMILES notation for 2-[7-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]imidazo[1,2-b][1,2,4]triazin-3-yl]propan-2-ol?
The canonical SMILES for 2-[7-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]imidazo[1,2-b][1,2,4]triazin-3-yl]propan-2-ol is CC(C)(O)c1cnn2c(-c3ccc(F)c(-c4ncccc4F)c3)cnc2n1.
What is the InChIKey of 2-[7-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]imidazo[1,2-b][1,2,4]triazin-3-yl]propan-2-ol?
The InChIKey is WIACWFSVQJVNGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F2N5O/c1-19(2,27)16-10-24-26-15(9-23-18(26)25-16)11-5-6-13(20)12(8-11)17-14(21)4-3-7-22-17/h3-10,27H,1-2H3.
What are the key properties of 2-[7-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]imidazo[1,2-b][1,2,4]triazin-3-yl]propan-2-ol?
2-[7-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]imidazo[1,2-b][1,2,4]triazin-3-yl]propan-2-ol has a molecular weight of 367.36 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[7-[4-fluoro-3-(3-fluoro-2-pyridinyl)phenyl]imidazo[1,2-b][1,2,4]triazin-3-yl]propan-2-ol is sourced from PubChem (CID 10133554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).