8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(6-methyl-3-pyridinyl)imidazo[1,5-c]pyrimidin-5-amine

C27H24FN7O — CID 139346264

IUPAC8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(6-methyl-3-pyridinyl)imidazo[1,5-c]pyrimidin-5-amine
SMILESCc1ccc(-c2ncn3c(NCc4c(F)ccc5c4CCO5)ncc(-c4cnc(C)nc4C)c23)cn1
InChIInChI=1S/C27H24FN7O/c1-15-4-5-18(10-29-15)25-26-22(20-11-30-17(3)34-16(20)2)13-32-27(35(26)14-33-25)31-12-21-19-8-9-36-24(19)7-6-23(21)28/h4-7,10-11,13-14H,8-9,12H2,1-3H3,(H,31,32)
InChIKeyUATGKUUUDPUKBJ-UHFFFAOYSA-N
MW481.54 g/mol
LogP4.86
Rot. Bonds5

About 8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(6-methyl-3-pyridinyl)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-(6-methyl-3-pyridinyl)imidazo[1,5-c]pyrimidin-5-amine (PubChem CID 139346264) has the molecular formula C27H24FN7O and a molecular weight of 481.54 g/mol. Its IUPAC name is 8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(6-methyl-3-pyridinyl)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-(6-methyl-3-pyridinyl)imidazo[1,5-c]pyrimidin-5-amine
PubChem CID139346264
Molecular FormulaC27H24FN7O
Molecular Weight481.54 g/mol
Exact Mass481.20
IUPAC Name8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(6-methyl-3-pyridinyl)imidazo[1,5-c]pyrimidin-5-amine
SMILESCc1ccc(-c2ncn3c(NCc4c(F)ccc5c4CCO5)ncc(-c4cnc(C)nc4C)c23)cn1
InChIInChI=1S/C27H24FN7O/c1-15-4-5-18(10-29-15)25-26-22(20-11-30-17(3)34-16(20)2)13-32-27(35(26)14-33-25)31-12-21-19-8-9-36-24(19)7-6-23(21)28/h4-7,10-11,13-14H,8-9,12H2,1-3H3,(H,31,32)
InChIKeyUATGKUUUDPUKBJ-UHFFFAOYSA-N
XLogP4.86
TPSA90.12 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500481.54
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze 8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(6-methyl-3-pyridinyl)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-(6-methyl-3-pyridinyl)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-(6-methyl-3-pyridinyl)imidazo[1,5-c]pyrimidin-5-amine (CID 139346264) is 8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(6-methyl-3-pyridinyl)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-(6-methyl-3-pyridinyl)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-(6-methyl-3-pyridinyl)imidazo[1,5-c]pyrimidin-5-amine is Cc1ccc(-c2ncn3c(NCc4c(F)ccc5c4CCO5)ncc(-c4cnc(C)nc4C)c23)cn1.
What is the InChIKey of 8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(6-methyl-3-pyridinyl)imidazo[1,5-c]pyrimidin-5-amine?
The InChIKey is UATGKUUUDPUKBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24FN7O/c1-15-4-5-18(10-29-15)25-26-22(20-11-30-17(3)34-16(20)2)13-32-27(35(26)14-33-25)31-12-21-19-8-9-36-24(19)7-6-23(21)28/h4-7,10-11,13-14H,8-9,12H2,1-3H3,(H,31,32).
What are the key properties of 8-(2,4-dimethylpyrimidin-5-yl)-N-[(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)methyl]-1-(6-methyl-3-pyridinyl)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-(6-methyl-3-pyridinyl)imidazo[1,5-c]pyrimidin-5-amine has a molecular weight of 481.54 g/mol, XLogP of 4.86, 5 rotatable bonds, 1 hydrogen bond donors, and 8 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-(6-methyl-3-pyridinyl)imidazo[1,5-c]pyrimidin-5-amine is sourced from PubChem (CID 139346264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).