N-dibenzofuran-3-yl-5-fluoro-4-imidazol-1-ylpyrimidin-2-amine

C19H12FN5O — CID 86300823

IUPACN-dibenzofuran-3-yl-5-fluoro-4-imidazol-1-ylpyrimidin-2-amine
SMILESFc1cnc(Nc2ccc3c(c2)oc2ccccc23)nc1-n1ccnc1
InChIInChI=1S/C19H12FN5O/c20-15-10-22-19(24-18(15)25-8-7-21-11-25)23-12-5-6-14-13-3-1-2-4-16(13)26-17(14)9-12/h1-11H,(H,22,23,24)
InChIKeyYFZQMWMZTBAPST-UHFFFAOYSA-N
MW345.34 g/mol
LogP4.44
Rot. Bonds3

About N-dibenzofuran-3-yl-5-fluoro-4-imidazol-1-ylpyrimidin-2-amine

N-dibenzofuran-3-yl-5-fluoro-4-imidazol-1-ylpyrimidin-2-amine (PubChem CID 86300823) has the molecular formula C19H12FN5O and a molecular weight of 345.34 g/mol. Its IUPAC name is N-dibenzofuran-3-yl-5-fluoro-4-imidazol-1-ylpyrimidin-2-amine.

Molecular Properties

Compound NameN-dibenzofuran-3-yl-5-fluoro-4-imidazol-1-ylpyrimidin-2-amine
PubChem CID86300823
Molecular FormulaC19H12FN5O
Molecular Weight345.34 g/mol
Exact Mass345.10
IUPAC NameN-dibenzofuran-3-yl-5-fluoro-4-imidazol-1-ylpyrimidin-2-amine
SMILESFc1cnc(Nc2ccc3c(c2)oc2ccccc23)nc1-n1ccnc1
InChIInChI=1S/C19H12FN5O/c20-15-10-22-19(24-18(15)25-8-7-21-11-25)23-12-5-6-14-13-3-1-2-4-16(13)26-17(14)9-12/h1-11H,(H,22,23,24)
InChIKeyYFZQMWMZTBAPST-UHFFFAOYSA-N
XLogP4.44
TPSA68.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.34
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-3-yl-5-fluoro-4-imidazol-1-ylpyrimidin-2-amine?
The IUPAC name of N-dibenzofuran-3-yl-5-fluoro-4-imidazol-1-ylpyrimidin-2-amine (CID 86300823) is N-dibenzofuran-3-yl-5-fluoro-4-imidazol-1-ylpyrimidin-2-amine.
What is the SMILES notation for N-dibenzofuran-3-yl-5-fluoro-4-imidazol-1-ylpyrimidin-2-amine?
The canonical SMILES for N-dibenzofuran-3-yl-5-fluoro-4-imidazol-1-ylpyrimidin-2-amine is Fc1cnc(Nc2ccc3c(c2)oc2ccccc23)nc1-n1ccnc1.
What is the InChIKey of N-dibenzofuran-3-yl-5-fluoro-4-imidazol-1-ylpyrimidin-2-amine?
The InChIKey is YFZQMWMZTBAPST-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12FN5O/c20-15-10-22-19(24-18(15)25-8-7-21-11-25)23-12-5-6-14-13-3-1-2-4-16(13)26-17(14)9-12/h1-11H,(H,22,23,24).
What are the key properties of N-dibenzofuran-3-yl-5-fluoro-4-imidazol-1-ylpyrimidin-2-amine?
N-dibenzofuran-3-yl-5-fluoro-4-imidazol-1-ylpyrimidin-2-amine has a molecular weight of 345.34 g/mol, XLogP of 4.44, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-3-yl-5-fluoro-4-imidazol-1-ylpyrimidin-2-amine is sourced from PubChem (CID 86300823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).