imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine

C28H23N13S2 — CID 19832713

IUPACimidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine
SMILESc1cc2nccn2cn1.c1ccn2ccnc2c1.c1cn2ccsc2n1.c1cn2ncsc2n1.c1cnc2nccn2c1
InChIInChI=1S/C7H6N2.2C6H5N3.C5H4N2S.C4H3N3S/c1-2-5-9-6-4-8-7(9)3-1;1-2-7-5-9-4-3-8-6(1)9;1-2-7-6-8-3-5-9(6)4-1;1-2-7-3-4-8-5(7)6-1;1-2-7-4(5-1)8-3-6-7/h1-6H;2*1-5H;1-4H;1-3H
InChIKeyCTRSHDNYRKUENG-UHFFFAOYSA-N
MW605.72 g/mol
LogP4.98
Rot. Bonds

About imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine

imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine (PubChem CID 19832713) has the molecular formula C28H23N13S2 and a molecular weight of 605.72 g/mol. Its IUPAC name is imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine.

Molecular Properties

Compound Nameimidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine
PubChem CID19832713
Molecular FormulaC28H23N13S2
Molecular Weight605.72 g/mol
Exact Mass605.16
IUPAC Nameimidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine
SMILESc1cc2nccn2cn1.c1ccn2ccnc2c1.c1cn2ccsc2n1.c1cn2ncsc2n1.c1cnc2nccn2c1
InChIInChI=1S/C7H6N2.2C6H5N3.C5H4N2S.C4H3N3S/c1-2-5-9-6-4-8-7(9)3-1;1-2-7-5-9-4-3-8-6(1)9;1-2-7-6-8-3-5-9(6)4-1;1-2-7-3-4-8-5(7)6-1;1-2-7-4(5-1)8-3-6-7/h1-6H;2*1-5H;1-4H;1-3H
InChIKeyCTRSHDNYRKUENG-UHFFFAOYSA-N
XLogP4.98
TPSA125.17 Ų
H-Bond Donors
H-Bond Acceptors15
Rotatable Bonds
Heavy Atoms43
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500605.72
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1015

Analyze imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine with MolForge

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Related Compounds

carbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium)
CID 159110066
imidazo[1,2-a]pyrimidine
CID 577018
icosakis(2,2-dimethylpropane);imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;indolizine;methane;pyrazolo[1,5-a]pyrazine;pyrazolo[1,5-a]pyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrazolo[1,5-c]pyrimidine;bis(pyrrolo[1,2-a]pyrazine);bis(pyrrolo[1,2-a]pyrimidine);bis(pyrrolo[1,2-b]pyridazine);bis(pyrrolo[1,2-c]pyrimidine)
CID 158842149
ethane;bis(imidazo[1,2-a]pyrimidine)
CID 161252419
imidazo[1,2-a]pyridine;phenylmethanamine
CID 67154135
imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,2-c]pyrimidine;bis(pyrazolo[1,5-a][1,3,5]triazine);bis(pyrazolo[1,5-b][1,2,4]triazine);pyrazolo[1,5-c]triazine;pyrazolo[5,1-c][1,2,4]triazine;bis(pyrazolo[1,5-d][1,2,4]triazine);pyrazolo[5,1-f][1,2,4]triazine;[1,2,4]triazolo[1,5-c]triazine;[1,2,4]triazolo[5,1-f][1,2,4]triazine
CID 159253354
7-imidazo[1,2-a]pyridin-2-ylimidazo[1,2-c]pyrimidine
CID 139315871
imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyrimidine;imidazo[1,2-a][1,3,5]triazine;imidazo[1,2-b]pyridazine;imidazo[1,2-b][1,2,4]triazine;imidazo[1,2-c]pyrimidine;imidazo[1,2-c]triazine;imidazo[2,1-c][1,2,4]triazine;imidazo[1,2-d][1,2,4]triazine;imidazo[2,1-f][1,2,4]triazine;pyrrolo[1,2-c]triazine;pyrrolo[2,1-f][1,2,4]triazine
CID 160939450
acridine;ethane;imidazo[1,2-a]pyrazine;imidazo[1,2-a]pyridine;imidazo[1,2-a]quinoline;imidazo[1,2-a][1,3,5]triazine;imidazo[1,2-b]isoquinoline;imidazo[1,2-b]pyridazine;imidazo[1,2-b][1,2,4]triazine;imidazo[1,2-c]pyrimidine;imidazo[2,1-c][1,2,4]triazine;imidazo[2,1-f][1,2,4]triazine
CID 161122039
imidazo[1,2-a]pyridine;1H-imidazo[1,2-a]pyrimidin-4-ium;1H-imidazo[1,2-c]pyrimidin-4-ium
CID 158438415
6-pyridin-2-ylimidazo[1,2-b]pyridazine
CID 116854315
imidazo[1,2-a]pyrazine;imidazo[1,2-a][1,3,5]triazine;imidazo[1,2-b]pyridazine;imidazo[1,2-b][1,2,4]triazine;imidazo[1,2-c]pyrimidine;imidazo[1,2-c]triazine;imidazo[2,1-c][1,2,4]triazine;imidazo[1,2-d][1,2,4]triazine;imidazo[2,1-f][1,2,4]triazine;methane;tris(pyrazolo[1,5-a][1,3,5]triazine);bis(pyrazolo[1,5-b][1,2,4]triazine);bis(pyrazolo[1,5-c]triazine);tris(pyrazolo[5,1-c][1,2,4]triazine);bis(pyrazolo[1,5-d][1,2,4]triazine);bis(pyrazolo[5,1-f][1,2,4]triazine);pyrrolo[1,2-a]pyrimidine;pyrrolo[1,2-b][1,2,4]triazine;pyrrolo[1,2-c]triazine;pyrrolo[1,2-d][1,2,4]triazine;pyrrolo[2,1-f][1,2,4]triazine;[1,2,4]triazolo[1,5-a]pyridine;[1,2,4]triazolo[1,5-a][1,3,5]triazine;[1,2,4]triazolo[1,5-b][1,2,4]triazine;[1,2,4]triazolo[1,5-c]triazine;[1,2,4]triazolo[5,1-c][1,2,4]triazine;[1,2,4]triazolo[1,5-d][1,2,4]triazine;[1,2,4]triazolo[5,1-f][1,2,4]triazine
CID 160650713

Frequently Asked Questions

What is the IUPAC name of imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine?
The IUPAC name of imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine (CID 19832713) is imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine.
What is the SMILES notation for imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine?
The canonical SMILES for imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine is c1cc2nccn2cn1.c1ccn2ccnc2c1.c1cn2ccsc2n1.c1cn2ncsc2n1.c1cnc2nccn2c1.
What is the InChIKey of imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine?
The InChIKey is CTRSHDNYRKUENG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2.2C6H5N3.C5H4N2S.C4H3N3S/c1-2-5-9-6-4-8-7(9)3-1;1-2-7-5-9-4-3-8-6(1)9;1-2-7-6-8-3-5-9(6)4-1;1-2-7-3-4-8-5(7)6-1;1-2-7-4(5-1)8-3-6-7/h1-6H;2*1-5H;1-4H;1-3H.
What are the key properties of imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine?
imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine has a molecular weight of 605.72 g/mol, XLogP of 4.98, 0 rotatable bonds, 0 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;imidazo[2,1-b][1,3,4]thiadiazole;imidazo[2,1-b][1,3]thiazole;imidazo[1,2-c]pyrimidine is sourced from PubChem (CID 19832713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).