2-[3-[2-(2,4-dichlorophenyl)pyrimidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-7-yl]propan-2-ol

C20H15Cl2FN4O — CID 10319785

IUPAC2-[3-[2-(2,4-dichlorophenyl)pyrimidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-7-yl]propan-2-ol
SMILESCC(C)(O)c1ccn2c(-c3ccnc(-c4ccc(Cl)cc4Cl)n3)cnc2c1F
InChIInChI=1S/C20H15Cl2FN4O/c1-20(2,28)13-6-8-27-16(10-25-19(27)17(13)23)15-5-7-24-18(26-15)12-4-3-11(21)9-14(12)22/h3-10,28H,1-2H3
InChIKeyQPINCTRUJUZSBR-UHFFFAOYSA-N
MW417.27 g/mol
LogP5.13
Rot. Bonds3

About 2-[3-[2-(2,4-dichlorophenyl)pyrimidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-7-yl]propan-2-ol

2-[3-[2-(2,4-dichlorophenyl)pyrimidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-7-yl]propan-2-ol (PubChem CID 10319785) has the molecular formula C20H15Cl2FN4O and a molecular weight of 417.27 g/mol. Its IUPAC name is 2-[3-[2-(2,4-dichlorophenyl)pyrimidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-7-yl]propan-2-ol.

Molecular Properties

Compound Name2-[3-[2-(2,4-dichlorophenyl)pyrimidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-7-yl]propan-2-ol
PubChem CID10319785
Molecular FormulaC20H15Cl2FN4O
Molecular Weight417.27 g/mol
Exact Mass416.06
IUPAC Name2-[3-[2-(2,4-dichlorophenyl)pyrimidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-7-yl]propan-2-ol
SMILESCC(C)(O)c1ccn2c(-c3ccnc(-c4ccc(Cl)cc4Cl)n3)cnc2c1F
InChIInChI=1S/C20H15Cl2FN4O/c1-20(2,28)13-6-8-27-16(10-25-19(27)17(13)23)15-5-7-24-18(26-15)12-4-3-11(21)9-14(12)22/h3-10,28H,1-2H3
InChIKeyQPINCTRUJUZSBR-UHFFFAOYSA-N
XLogP5.13
TPSA63.31 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500417.27
LogP ≤ 55.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-[3-[2-(2,4-dichlorophenyl)pyrimidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-7-yl]propan-2-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[3-[2-(2,4-dichlorophenyl)pyrimidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-7-yl]propan-2-ol?
The IUPAC name of 2-[3-[2-(2,4-dichlorophenyl)pyrimidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-7-yl]propan-2-ol (CID 10319785) is 2-[3-[2-(2,4-dichlorophenyl)pyrimidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-7-yl]propan-2-ol.
What is the SMILES notation for 2-[3-[2-(2,4-dichlorophenyl)pyrimidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-7-yl]propan-2-ol?
The canonical SMILES for 2-[3-[2-(2,4-dichlorophenyl)pyrimidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-7-yl]propan-2-ol is CC(C)(O)c1ccn2c(-c3ccnc(-c4ccc(Cl)cc4Cl)n3)cnc2c1F.
What is the InChIKey of 2-[3-[2-(2,4-dichlorophenyl)pyrimidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-7-yl]propan-2-ol?
The InChIKey is QPINCTRUJUZSBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15Cl2FN4O/c1-20(2,28)13-6-8-27-16(10-25-19(27)17(13)23)15-5-7-24-18(26-15)12-4-3-11(21)9-14(12)22/h3-10,28H,1-2H3.
What are the key properties of 2-[3-[2-(2,4-dichlorophenyl)pyrimidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-7-yl]propan-2-ol?
2-[3-[2-(2,4-dichlorophenyl)pyrimidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-7-yl]propan-2-ol has a molecular weight of 417.27 g/mol, XLogP of 5.13, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[2-(2,4-dichlorophenyl)pyrimidin-4-yl]-8-fluoroimidazo[1,2-a]pyridin-7-yl]propan-2-ol is sourced from PubChem (CID 10319785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).