8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(1,3-oxazol-2-yl)imidazo[1,5-c]pyrimidin-5-amine

C24H20FN7O2 — CID 139346197

IUPAC8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(1,3-oxazol-2-yl)imidazo[1,5-c]pyrimidin-5-amine
SMILESCc1ncc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnc(-c4ncco4)c23)c(C)n1
InChIInChI=1S/C24H20FN7O2/c1-13-16(9-27-14(2)31-13)18-11-29-24(32-12-30-21(22(18)32)23-26-6-8-34-23)28-10-17-15-5-7-33-20(15)4-3-19(17)25/h3-4,6,8-9,11-12H,5,7,10H2,1-2H3,(H,28,29)
InChIKeyYPQWPAMAYXWZLK-UHFFFAOYSA-N
MW457.47 g/mol
LogP4.14
Rot. Bonds5

About 8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(1,3-oxazol-2-yl)imidazo[1,5-c]pyrimidin-5-amine

8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(1,3-oxazol-2-yl)imidazo[1,5-c]pyrimidin-5-amine (PubChem CID 139346197) has the molecular formula C24H20FN7O2 and a molecular weight of 457.47 g/mol. Its IUPAC name is 8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(1,3-oxazol-2-yl)imidazo[1,5-c]pyrimidin-5-amine.

Molecular Properties

Compound Name8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(1,3-oxazol-2-yl)imidazo[1,5-c]pyrimidin-5-amine
PubChem CID139346197
Molecular FormulaC24H20FN7O2
Molecular Weight457.47 g/mol
Exact Mass457.17
IUPAC Name8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(1,3-oxazol-2-yl)imidazo[1,5-c]pyrimidin-5-amine
SMILESCc1ncc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnc(-c4ncco4)c23)c(C)n1
InChIInChI=1S/C24H20FN7O2/c1-13-16(9-27-14(2)31-13)18-11-29-24(32-12-30-21(22(18)32)23-26-6-8-34-23)28-10-17-15-5-7-33-20(15)4-3-19(17)25/h3-4,6,8-9,11-12H,5,7,10H2,1-2H3,(H,28,29)
InChIKeyYPQWPAMAYXWZLK-UHFFFAOYSA-N
XLogP4.14
TPSA103.26 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500457.47
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Analyze 8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(1,3-oxazol-2-yl)imidazo[1,5-c]pyrimidin-5-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(1,3-oxazol-2-yl)imidazo[1,5-c]pyrimidin-5-amine?
The IUPAC name of 8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(1,3-oxazol-2-yl)imidazo[1,5-c]pyrimidin-5-amine (CID 139346197) is 8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(1,3-oxazol-2-yl)imidazo[1,5-c]pyrimidin-5-amine.
What is the SMILES notation for 8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(1,3-oxazol-2-yl)imidazo[1,5-c]pyrimidin-5-amine?
The canonical SMILES for 8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(1,3-oxazol-2-yl)imidazo[1,5-c]pyrimidin-5-amine is Cc1ncc(-c2cnc(NCc3c(F)ccc4c3CCO4)n3cnc(-c4ncco4)c23)c(C)n1.
What is the InChIKey of 8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(1,3-oxazol-2-yl)imidazo[1,5-c]pyrimidin-5-amine?
The InChIKey is YPQWPAMAYXWZLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20FN7O2/c1-13-16(9-27-14(2)31-13)18-11-29-24(32-12-30-21(22(18)32)23-26-6-8-34-23)28-10-17-15-5-7-33-20(15)4-3-19(17)25/h3-4,6,8-9,11-12H,5,7,10H2,1-2H3,(H,28,29).
What are the key properties of 8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(1,3-oxazol-2-yl)imidazo[1,5-c]pyrimidin-5-amine?
8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(1,3-oxazol-2-yl)imidazo[1,5-c]pyrimidin-5-amine has a molecular weight of 457.47 g/mol, XLogP of 4.14, 5 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(1,3-oxazol-2-yl)imidazo[1,5-c]pyrimidin-5-amine is sourced from PubChem (CID 139346197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).