1-[2-(4-fluorophenyl)-3-imidazo[1,2-a]pyrimidin-7-ylimidazo[1,2-a]pyridin-7-yl]-N,N-dimethylmethanamine

C22H19FN6 — CID 58824298

IUPAC1-[2-(4-fluorophenyl)-3-imidazo[1,2-a]pyrimidin-7-ylimidazo[1,2-a]pyridin-7-yl]-N,N-dimethylmethanamine
SMILESCN(C)Cc1ccn2c(-c3ccn4ccnc4n3)c(-c3ccc(F)cc3)nc2c1
InChIInChI=1S/C22H19FN6/c1-27(2)14-15-7-11-29-19(13-15)26-20(16-3-5-17(23)6-4-16)21(29)18-8-10-28-12-9-24-22(28)25-18/h3-13H,14H2,1-2H3
InChIKeyGBFMIOJGCJFYRQ-UHFFFAOYSA-N
MW386.43 g/mol
LogP3.91
Rot. Bonds4

About 1-[2-(4-fluorophenyl)-3-imidazo[1,2-a]pyrimidin-7-ylimidazo[1,2-a]pyridin-7-yl]-N,N-dimethylmethanamine

1-[2-(4-fluorophenyl)-3-imidazo[1,2-a]pyrimidin-7-ylimidazo[1,2-a]pyridin-7-yl]-N,N-dimethylmethanamine (PubChem CID 58824298) has the molecular formula C22H19FN6 and a molecular weight of 386.43 g/mol. Its IUPAC name is 1-[2-(4-fluorophenyl)-3-imidazo[1,2-a]pyrimidin-7-ylimidazo[1,2-a]pyridin-7-yl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[2-(4-fluorophenyl)-3-imidazo[1,2-a]pyrimidin-7-ylimidazo[1,2-a]pyridin-7-yl]-N,N-dimethylmethanamine
PubChem CID58824298
Molecular FormulaC22H19FN6
Molecular Weight386.43 g/mol
Exact Mass386.17
IUPAC Name1-[2-(4-fluorophenyl)-3-imidazo[1,2-a]pyrimidin-7-ylimidazo[1,2-a]pyridin-7-yl]-N,N-dimethylmethanamine
SMILESCN(C)Cc1ccn2c(-c3ccn4ccnc4n3)c(-c3ccc(F)cc3)nc2c1
InChIInChI=1S/C22H19FN6/c1-27(2)14-15-7-11-29-19(13-15)26-20(16-3-5-17(23)6-4-16)21(29)18-8-10-28-12-9-24-22(28)25-18/h3-13H,14H2,1-2H3
InChIKeyGBFMIOJGCJFYRQ-UHFFFAOYSA-N
XLogP3.91
TPSA50.73 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.43
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-fluorophenyl)-3-imidazo[1,2-a]pyrimidin-7-ylimidazo[1,2-a]pyridin-7-yl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[2-(4-fluorophenyl)-3-imidazo[1,2-a]pyrimidin-7-ylimidazo[1,2-a]pyridin-7-yl]-N,N-dimethylmethanamine (CID 58824298) is 1-[2-(4-fluorophenyl)-3-imidazo[1,2-a]pyrimidin-7-ylimidazo[1,2-a]pyridin-7-yl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[2-(4-fluorophenyl)-3-imidazo[1,2-a]pyrimidin-7-ylimidazo[1,2-a]pyridin-7-yl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[2-(4-fluorophenyl)-3-imidazo[1,2-a]pyrimidin-7-ylimidazo[1,2-a]pyridin-7-yl]-N,N-dimethylmethanamine is CN(C)Cc1ccn2c(-c3ccn4ccnc4n3)c(-c3ccc(F)cc3)nc2c1.
What is the InChIKey of 1-[2-(4-fluorophenyl)-3-imidazo[1,2-a]pyrimidin-7-ylimidazo[1,2-a]pyridin-7-yl]-N,N-dimethylmethanamine?
The InChIKey is GBFMIOJGCJFYRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19FN6/c1-27(2)14-15-7-11-29-19(13-15)26-20(16-3-5-17(23)6-4-16)21(29)18-8-10-28-12-9-24-22(28)25-18/h3-13H,14H2,1-2H3.
What are the key properties of 1-[2-(4-fluorophenyl)-3-imidazo[1,2-a]pyrimidin-7-ylimidazo[1,2-a]pyridin-7-yl]-N,N-dimethylmethanamine?
1-[2-(4-fluorophenyl)-3-imidazo[1,2-a]pyrimidin-7-ylimidazo[1,2-a]pyridin-7-yl]-N,N-dimethylmethanamine has a molecular weight of 386.43 g/mol, XLogP of 3.91, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-fluorophenyl)-3-imidazo[1,2-a]pyrimidin-7-ylimidazo[1,2-a]pyridin-7-yl]-N,N-dimethylmethanamine is sourced from PubChem (CID 58824298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).