(2,6-dimethylmorpholin-4-yl)-[6-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone

C20H24FN3O2 — CID 46170786

IUPAC(2,6-dimethylmorpholin-4-yl)-[6-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone
SMILESCC1CN(C(=O)c2cn3c(n2)CCC(c2cccc(F)c2)C3)CC(C)O1
InChIInChI=1S/C20H24FN3O2/c1-13-9-24(10-14(2)26-13)20(25)18-12-23-11-16(6-7-19(23)22-18)15-4-3-5-17(21)8-15/h3-5,8,12-14,16H,6-7,9-11H2,1-2H3
InChIKeyCAMARERXIUGVJQ-UHFFFAOYSA-N
MW357.43 g/mol
LogP3.00
Rot. Bonds2

About (2,6-dimethylmorpholin-4-yl)-[6-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone

(2,6-dimethylmorpholin-4-yl)-[6-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone (PubChem CID 46170786) has the molecular formula C20H24FN3O2 and a molecular weight of 357.43 g/mol. Its IUPAC name is (2,6-dimethylmorpholin-4-yl)-[6-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone.

Molecular Properties

Compound Name(2,6-dimethylmorpholin-4-yl)-[6-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone
PubChem CID46170786
Molecular FormulaC20H24FN3O2
Molecular Weight357.43 g/mol
Exact Mass357.19
IUPAC Name(2,6-dimethylmorpholin-4-yl)-[6-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone
SMILESCC1CN(C(=O)c2cn3c(n2)CCC(c2cccc(F)c2)C3)CC(C)O1
InChIInChI=1S/C20H24FN3O2/c1-13-9-24(10-14(2)26-13)20(25)18-12-23-11-16(6-7-19(23)22-18)15-4-3-5-17(21)8-15/h3-5,8,12-14,16H,6-7,9-11H2,1-2H3
InChIKeyCAMARERXIUGVJQ-UHFFFAOYSA-N
XLogP3.00
TPSA47.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.43
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1,3-Dimethyl-8-morpholin-4-ylmethyl-7-phenethyl-3,7-dihydro-purine-2,6-dione
CID 647188
8-[(dibenzylamino)methyl]-7-(2-ethoxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
CID 3740004
8-[(4-Benzylpiperazin-1-yl)methyl]-1,3-dimethyl-7-(2-morpholin-4-ylethyl)purine-2,6-dione
CID 662827
1,3-Dimethyl-7-(4-methyl-benzyl)-8-morpholin-4-ylmethyl-3,7-dihydro-purine-2,6-dione
CID 653828
8-{[benzyl(methyl)amino]methyl}-7-(2-methoxyethyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
CID 2987290
1,3-Dimethyl-8-(4-morpholinyl)-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
CID 981032
Ethyl 13-fluoro-7-oxo-2,5,8-triazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15),11,13-hexaene-4-carboxylate
CID 19691070
(1-Methylimidazol-4-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 72195775
(3-Methylimidazol-4-yl)-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 72195777
Imidazo[1,2-a]pyridin-2-yl-[4-[2-(trifluoromethyl)phenyl]piperidin-1-yl]methanone
CID 117607528
9-benzyl-3-(2-ethoxyethyl)-1-methyl-6,7,8,9-tetrahydropyrimido[2,1-f]purine-2,4(1H,3H)-dione
CID 4584810
7-Benzyl-1,3-dimethyl-8-morpholin-4-ylmethyl-3,7-dihydro-purine-2,6-dione
CID 649234

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethylmorpholin-4-yl)-[6-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone?
The IUPAC name of (2,6-dimethylmorpholin-4-yl)-[6-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone (CID 46170786) is (2,6-dimethylmorpholin-4-yl)-[6-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone.
What is the SMILES notation for (2,6-dimethylmorpholin-4-yl)-[6-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone?
The canonical SMILES for (2,6-dimethylmorpholin-4-yl)-[6-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone is CC1CN(C(=O)c2cn3c(n2)CCC(c2cccc(F)c2)C3)CC(C)O1.
What is the InChIKey of (2,6-dimethylmorpholin-4-yl)-[6-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone?
The InChIKey is CAMARERXIUGVJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FN3O2/c1-13-9-24(10-14(2)26-13)20(25)18-12-23-11-16(6-7-19(23)22-18)15-4-3-5-17(21)8-15/h3-5,8,12-14,16H,6-7,9-11H2,1-2H3.
What are the key properties of (2,6-dimethylmorpholin-4-yl)-[6-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone?
(2,6-dimethylmorpholin-4-yl)-[6-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone has a molecular weight of 357.43 g/mol, XLogP of 3.00, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethylmorpholin-4-yl)-[6-(3-fluorophenyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl]methanone is sourced from PubChem (CID 46170786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).