2-[(4-fluorophenoxy)methyl]-6-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyrimidine

C19H15FN4O2 — CID 122506554

IUPAC2-[(4-fluorophenoxy)methyl]-6-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyrimidine
SMILESCOc1cc(-c2cnc3nc(COc4ccc(F)cc4)cn3c2)ccn1
InChIInChI=1S/C19H15FN4O2/c1-25-18-8-13(6-7-21-18)14-9-22-19-23-16(11-24(19)10-14)12-26-17-4-2-15(20)3-5-17/h2-11H,12H2,1H3
InChIKeyGRAXOLFOOYKYSM-UHFFFAOYSA-N
MW350.35 g/mol
LogP3.52
Rot. Bonds5

About 2-[(4-fluorophenoxy)methyl]-6-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyrimidine

2-[(4-fluorophenoxy)methyl]-6-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyrimidine (PubChem CID 122506554) has the molecular formula C19H15FN4O2 and a molecular weight of 350.35 g/mol. Its IUPAC name is 2-[(4-fluorophenoxy)methyl]-6-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name2-[(4-fluorophenoxy)methyl]-6-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyrimidine
PubChem CID122506554
Molecular FormulaC19H15FN4O2
Molecular Weight350.35 g/mol
Exact Mass350.12
IUPAC Name2-[(4-fluorophenoxy)methyl]-6-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyrimidine
SMILESCOc1cc(-c2cnc3nc(COc4ccc(F)cc4)cn3c2)ccn1
InChIInChI=1S/C19H15FN4O2/c1-25-18-8-13(6-7-21-18)14-9-22-19-23-16(11-24(19)10-14)12-26-17-4-2-15(20)3-5-17/h2-11H,12H2,1H3
InChIKeyGRAXOLFOOYKYSM-UHFFFAOYSA-N
XLogP3.52
TPSA61.54 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.35
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-fluorophenoxy)methyl]-6-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyrimidine?
The IUPAC name of 2-[(4-fluorophenoxy)methyl]-6-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyrimidine (CID 122506554) is 2-[(4-fluorophenoxy)methyl]-6-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyrimidine.
What is the SMILES notation for 2-[(4-fluorophenoxy)methyl]-6-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyrimidine?
The canonical SMILES for 2-[(4-fluorophenoxy)methyl]-6-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyrimidine is COc1cc(-c2cnc3nc(COc4ccc(F)cc4)cn3c2)ccn1.
What is the InChIKey of 2-[(4-fluorophenoxy)methyl]-6-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyrimidine?
The InChIKey is GRAXOLFOOYKYSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN4O2/c1-25-18-8-13(6-7-21-18)14-9-22-19-23-16(11-24(19)10-14)12-26-17-4-2-15(20)3-5-17/h2-11H,12H2,1H3.
What are the key properties of 2-[(4-fluorophenoxy)methyl]-6-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyrimidine?
2-[(4-fluorophenoxy)methyl]-6-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyrimidine has a molecular weight of 350.35 g/mol, XLogP of 3.52, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-fluorophenoxy)methyl]-6-(2-methoxy-4-pyridinyl)imidazo[1,2-a]pyrimidine is sourced from PubChem (CID 122506554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).