2-chloro-4-methoxy-5-methylpyrimidine;6-fluoroimidazo[1,2-a]pyridine;2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-1H-pyrimidin-6-one;6-fluoro-3-(4-methoxy-5-methylpyrimidin-2-yl)imidazo[1,2-a]pyridine

C38H32ClF3N12O3 — CID 160775805

IUPAC2-chloro-4-methoxy-5-methylpyrimidine;6-fluoroimidazo[1,2-a]pyridine;2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-1H-pyrimidin-6-one;6-fluoro-3-(4-methoxy-5-methylpyrimidin-2-yl)imidazo[1,2-a]pyridine
SMILESCOc1nc(-c2cnc3ccc(F)cn23)ncc1C.COc1nc(Cl)ncc1C.Cc1cnc(-c2cnc3ccc(F)cn23)[nH]c1=O.Fc1ccc2nccn2c1
InChIInChI=1S/C13H11FN4O.C12H9FN4O.C7H5FN2.C6H7ClN2O/c1-8-5-16-12(17-13(8)19-2)10-6-15-11-4-3-9(14)7-18(10)11;1-7-4-15-11(16-12(7)18)9-5-14-10-3-2-8(13)6-17(9)10;8-6-1-2-7-9-3-4-10(7)5-6;1-4-3-8-6(7)9-5(4)10-2/h3-7H,1-2H3;2-6H,1H3,(H,15,16,18);1-5H;3H,1-2H3
InChIKeyRZXSOOKUZQMWKB-UHFFFAOYSA-N
MW797.20 g/mol
LogP6.70
Rot. Bonds4

About 2-chloro-4-methoxy-5-methylpyrimidine;6-fluoroimidazo[1,2-a]pyridine;2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-1H-pyrimidin-6-one;6-fluoro-3-(4-methoxy-5-methylpyrimidin-2-yl)imidazo[1,2-a]pyridine

2-chloro-4-methoxy-5-methylpyrimidine;6-fluoroimidazo[1,2-a]pyridine;2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-1H-pyrimidin-6-one;6-fluoro-3-(4-methoxy-5-methylpyrimidin-2-yl)imidazo[1,2-a]pyridine (PubChem CID 160775805) has the molecular formula C38H32ClF3N12O3 and a molecular weight of 797.20 g/mol. Its IUPAC name is 2-chloro-4-methoxy-5-methylpyrimidine;6-fluoroimidazo[1,2-a]pyridine;2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-1H-pyrimidin-6-one;6-fluoro-3-(4-methoxy-5-methylpyrimidin-2-yl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-chloro-4-methoxy-5-methylpyrimidine;6-fluoroimidazo[1,2-a]pyridine;2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-1H-pyrimidin-6-one;6-fluoro-3-(4-methoxy-5-methylpyrimidin-2-yl)imidazo[1,2-a]pyridine
PubChem CID160775805
Molecular FormulaC38H32ClF3N12O3
Molecular Weight797.20 g/mol
Exact Mass796.24
IUPAC Name2-chloro-4-methoxy-5-methylpyrimidine;6-fluoroimidazo[1,2-a]pyridine;2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-1H-pyrimidin-6-one;6-fluoro-3-(4-methoxy-5-methylpyrimidin-2-yl)imidazo[1,2-a]pyridine
SMILESCOc1nc(-c2cnc3ccc(F)cn23)ncc1C.COc1nc(Cl)ncc1C.Cc1cnc(-c2cnc3ccc(F)cn23)[nH]c1=O.Fc1ccc2nccn2c1
InChIInChI=1S/C13H11FN4O.C12H9FN4O.C7H5FN2.C6H7ClN2O/c1-8-5-16-12(17-13(8)19-2)10-6-15-11-4-3-9(14)7-18(10)11;1-7-4-15-11(16-12(7)18)9-5-14-10-3-2-8(13)6-17(9)10;8-6-1-2-7-9-3-4-10(7)5-6;1-4-3-8-6(7)9-5(4)10-2/h3-7H,1-2H3;2-6H,1H3,(H,15,16,18);1-5H;3H,1-2H3
InChIKeyRZXSOOKUZQMWKB-UHFFFAOYSA-N
XLogP6.70
TPSA167.67 Ų
H-Bond Donors1
H-Bond Acceptors14
Rotatable Bonds4
Heavy Atoms57
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500797.20
LogP ≤ 56.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1014

Analyze 2-chloro-4-methoxy-5-methylpyrimidine;6-fluoroimidazo[1,2-a]pyridine;2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-1H-pyrimidin-6-one;6-fluoro-3-(4-methoxy-5-methylpyrimidin-2-yl)imidazo[1,2-a]pyridine with MolForge

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Related Compounds

3-[(3R)-3-[[2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-5-(trifluoromethyl)pyrimidin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile
CID 53260937
3-[3-[[2-(6-Fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-5-(trifluoromethyl)pyrimidin-4-yl]amino]piperidin-1-yl]-3-oxopropanenitrile
CID 67256576
tert-butyl (3R)-3-aminopiperidine-1-carboxylate;tert-butyl (3R)-3-[[2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-5-(trifluoromethyl)pyrimidin-4-yl]amino]piperidine-1-carboxylate
CID 158382295
6-fluoro-3-[4-fluoro-6-methoxy-5-(trifluoromethyl)pyrimidin-2-yl]imidazo[1,2-a]pyridine;6-fluoroimidazo[1,2-a]pyridine-3-carboximidamide;(E)-1,3,3,3-tetrafluoro-1-methoxy-2-methylprop-1-ene
CID 160133299
N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-4-methoxy-2-piperazin-1-ylpyrimidine-5-carboxamide
CID 169797461
2-(3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)-4-ethoxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrimidine-5-carboxamide
CID 176102663
4-ethoxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-piperidin-4-ylpiperazin-1-yl)pyrimidine-5-carboxamide
CID 177108546
4-ethoxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-piperazin-1-ylpiperidin-1-yl)pyrimidine-5-carboxamide
CID 177108552
4-ethoxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(3-piperazin-1-ylpyrrolidin-1-yl)pyrimidine-5-carboxamide
CID 177108594
4-ethoxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(4-pyrrolidin-3-ylpiperazin-1-yl)pyrimidine-5-carboxamide
CID 177108603
2-[(1S,4S)-2,5-diazabicyclo[2.2.1]heptan-2-yl]-4-ethoxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)pyrimidine-5-carboxamide
CID 177108703
4-ethoxy-N-(8-fluoro-2-methylimidazo[1,2-a]pyridin-6-yl)-2-(3-piperazin-1-ylpiperidin-1-yl)pyrimidine-5-carboxamide
CID 177108713

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-methoxy-5-methylpyrimidine;6-fluoroimidazo[1,2-a]pyridine;2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-1H-pyrimidin-6-one;6-fluoro-3-(4-methoxy-5-methylpyrimidin-2-yl)imidazo[1,2-a]pyridine?
The IUPAC name of 2-chloro-4-methoxy-5-methylpyrimidine;6-fluoroimidazo[1,2-a]pyridine;2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-1H-pyrimidin-6-one;6-fluoro-3-(4-methoxy-5-methylpyrimidin-2-yl)imidazo[1,2-a]pyridine (CID 160775805) is 2-chloro-4-methoxy-5-methylpyrimidine;6-fluoroimidazo[1,2-a]pyridine;2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-1H-pyrimidin-6-one;6-fluoro-3-(4-methoxy-5-methylpyrimidin-2-yl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 2-chloro-4-methoxy-5-methylpyrimidine;6-fluoroimidazo[1,2-a]pyridine;2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-1H-pyrimidin-6-one;6-fluoro-3-(4-methoxy-5-methylpyrimidin-2-yl)imidazo[1,2-a]pyridine?
The canonical SMILES for 2-chloro-4-methoxy-5-methylpyrimidine;6-fluoroimidazo[1,2-a]pyridine;2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-1H-pyrimidin-6-one;6-fluoro-3-(4-methoxy-5-methylpyrimidin-2-yl)imidazo[1,2-a]pyridine is COc1nc(-c2cnc3ccc(F)cn23)ncc1C.COc1nc(Cl)ncc1C.Cc1cnc(-c2cnc3ccc(F)cn23)[nH]c1=O.Fc1ccc2nccn2c1.
What is the InChIKey of 2-chloro-4-methoxy-5-methylpyrimidine;6-fluoroimidazo[1,2-a]pyridine;2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-1H-pyrimidin-6-one;6-fluoro-3-(4-methoxy-5-methylpyrimidin-2-yl)imidazo[1,2-a]pyridine?
The InChIKey is RZXSOOKUZQMWKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN4O.C12H9FN4O.C7H5FN2.C6H7ClN2O/c1-8-5-16-12(17-13(8)19-2)10-6-15-11-4-3-9(14)7-18(10)11;1-7-4-15-11(16-12(7)18)9-5-14-10-3-2-8(13)6-17(9)10;8-6-1-2-7-9-3-4-10(7)5-6;1-4-3-8-6(7)9-5(4)10-2/h3-7H,1-2H3;2-6H,1H3,(H,15,16,18);1-5H;3H,1-2H3.
What are the key properties of 2-chloro-4-methoxy-5-methylpyrimidine;6-fluoroimidazo[1,2-a]pyridine;2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-1H-pyrimidin-6-one;6-fluoro-3-(4-methoxy-5-methylpyrimidin-2-yl)imidazo[1,2-a]pyridine?
2-chloro-4-methoxy-5-methylpyrimidine;6-fluoroimidazo[1,2-a]pyridine;2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-1H-pyrimidin-6-one;6-fluoro-3-(4-methoxy-5-methylpyrimidin-2-yl)imidazo[1,2-a]pyridine has a molecular weight of 797.20 g/mol, XLogP of 6.70, 4 rotatable bonds, 1 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-methoxy-5-methylpyrimidine;6-fluoroimidazo[1,2-a]pyridine;2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-1H-pyrimidin-6-one;6-fluoro-3-(4-methoxy-5-methylpyrimidin-2-yl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 160775805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).