tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;5H-cyclopenta[c]pyridine;furo[2,3-b]pyrazine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-c]pyridine;tris(2H-pyrrolo[2,3-c]pyridine);tris(2H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine

C162H128N44O5S5 — CID 160651720

IUPACtris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;5H-cyclopenta[c]pyridine;furo[2,3-b]pyrazine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-c]pyridine;tris(2H-pyrrolo[2,3-c]pyridine);tris(2H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine
SMILESC1=Cc2cnccc2C1.C1=Cc2nnccc2C1.C1=Nc2cnccc2C1.C1=c2ccncc2=NC1.C1=c2ccncc2=NC1.C1=c2ccncc2=NC1.C1=c2cnccc2=NC1.C1=c2cnccc2=NC1.C1=c2cnccc2=NC1.C1=c2nccnc2=CC1.C1=c2nccnc2=CC1.C1=c2nccnc2=CC1.c1cc2cc[nH]c2cn1.c1cc2ccoc2cn1.c1cc2ccsc2cn1.c1cc2ncoc2cn1.c1cc2ncsc2cn1.c1cc2occc2cn1.c1cc2ocnc2cn1.c1cc2sccc2cn1.c1cc2scnc2cn1.c1cnc2[nH]ccc2n1.c1cnc2occc2n1.c1cnc2sccc2n1
InChIInChI=1S/C8H7N.12C7H6N2.2C7H5NO.2C7H5NS.C6H5N3.3C6H4N2O.3C6H4N2S/c1-2-7-4-5-9-6-8(7)3-1;3*1-4-9-7-2-3-8-5-6(1)7;5*1-3-8-5-7-6(1)2-4-9-7;3*1-2-6-7(3-1)9-5-4-8-6;1-2-6-4-5-8-9-7(6)3-1;1-3-8-5-6-2-4-9-7(1)6;1-3-8-5-7-6(1)2-4-9-7;1-3-8-5-6-2-4-9-7(1)6;1-3-8-5-7-6(1)2-4-9-7;1-2-8-6-5(1)7-3-4-9-6;1-4-9-6-5(1)7-2-3-8-6;1-2-7-3-5-6(1)9-4-8-5;1-2-7-3-6-5(1)8-4-9-6;1-4-9-6-5(1)7-2-3-8-6;1-2-7-3-5-6(1)9-4-8-5;1-2-7-3-6-5(1)8-4-9-6/h1,3-6H,2H2;3*1-3,5H,4H2;1,3-5H,2H2;3*1-3,5H,4H2;1-5,9H;3*2-5H,1H2;1,3-5H,2H2;4*1-5H;1-4H,(H,8,9);6*1-4H
InChIKeyRKMYPESDXNTXQX-UHFFFAOYSA-N
MW2931.44 g/mol
LogP18.84
Rot. Bonds

About tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;5H-cyclopenta[c]pyridine;furo[2,3-b]pyrazine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-c]pyridine;tris(2H-pyrrolo[2,3-c]pyridine);tris(2H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine

tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;5H-cyclopenta[c]pyridine;furo[2,3-b]pyrazine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-c]pyridine;tris(2H-pyrrolo[2,3-c]pyridine);tris(2H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine (PubChem CID 160651720) has the molecular formula C162H128N44O5S5 and a molecular weight of 2931.44 g/mol. Its IUPAC name is tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;5H-cyclopenta[c]pyridine;furo[2,3-b]pyrazine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-c]pyridine;tris(2H-pyrrolo[2,3-c]pyridine);tris(2H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine.

Molecular Properties

Compound Nametris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;5H-cyclopenta[c]pyridine;furo[2,3-b]pyrazine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-c]pyridine;tris(2H-pyrrolo[2,3-c]pyridine);tris(2H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine
PubChem CID160651720
Molecular FormulaC162H128N44O5S5
Molecular Weight2931.44 g/mol
Exact Mass2928.97
IUPAC Nametris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;5H-cyclopenta[c]pyridine;furo[2,3-b]pyrazine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-c]pyridine;tris(2H-pyrrolo[2,3-c]pyridine);tris(2H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine
SMILESC1=Cc2cnccc2C1.C1=Cc2nnccc2C1.C1=Nc2cnccc2C1.C1=c2ccncc2=NC1.C1=c2ccncc2=NC1.C1=c2ccncc2=NC1.C1=c2cnccc2=NC1.C1=c2cnccc2=NC1.C1=c2cnccc2=NC1.C1=c2nccnc2=CC1.C1=c2nccnc2=CC1.C1=c2nccnc2=CC1.c1cc2cc[nH]c2cn1.c1cc2ccoc2cn1.c1cc2ccsc2cn1.c1cc2ncoc2cn1.c1cc2ncsc2cn1.c1cc2occc2cn1.c1cc2ocnc2cn1.c1cc2sccc2cn1.c1cc2scnc2cn1.c1cnc2[nH]ccc2n1.c1cnc2occc2n1.c1cnc2sccc2n1
InChIInChI=1S/C8H7N.12C7H6N2.2C7H5NO.2C7H5NS.C6H5N3.3C6H4N2O.3C6H4N2S/c1-2-7-4-5-9-6-8(7)3-1;3*1-4-9-7-2-3-8-5-6(1)7;5*1-3-8-5-7-6(1)2-4-9-7;3*1-2-6-7(3-1)9-5-4-8-6;1-2-6-4-5-8-9-7(6)3-1;1-3-8-5-6-2-4-9-7(1)6;1-3-8-5-7-6(1)2-4-9-7;1-3-8-5-6-2-4-9-7(1)6;1-3-8-5-7-6(1)2-4-9-7;1-2-8-6-5(1)7-3-4-9-6;1-4-9-6-5(1)7-2-3-8-6;1-2-7-3-5-6(1)9-4-8-5;1-2-7-3-6-5(1)8-4-9-6;1-4-9-6-5(1)7-2-3-8-6;1-2-7-3-5-6(1)9-4-8-5;1-2-7-3-6-5(1)8-4-9-6/h1,3-6H,2H2;3*1-3,5H,4H2;1,3-5H,2H2;3*1-3,5H,4H2;1-5,9H;3*2-5H,1H2;1,3-5H,2H2;4*1-5H;1-4H,(H,8,9);6*1-4H
InChIKeyRKMYPESDXNTXQX-UHFFFAOYSA-N
XLogP18.84
TPSA634.95 Ų
H-Bond Donors2
H-Bond Acceptors52
Rotatable Bonds
Heavy Atoms216
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002931.44
LogP ≤ 518.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1052

Analyze tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;5H-cyclopenta[c]pyridine;furo[2,3-b]pyrazine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-c]pyridine;tris(2H-pyrrolo[2,3-c]pyridine);tris(2H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;5H-cyclopenta[c]pyridine;furo[2,3-b]pyrazine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-c]pyridine;tris(2H-pyrrolo[2,3-c]pyridine);tris(2H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine?
The IUPAC name of tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;5H-cyclopenta[c]pyridine;furo[2,3-b]pyrazine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-c]pyridine;tris(2H-pyrrolo[2,3-c]pyridine);tris(2H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine (CID 160651720) is tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;5H-cyclopenta[c]pyridine;furo[2,3-b]pyrazine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-c]pyridine;tris(2H-pyrrolo[2,3-c]pyridine);tris(2H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine.
What is the SMILES notation for tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;5H-cyclopenta[c]pyridine;furo[2,3-b]pyrazine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-c]pyridine;tris(2H-pyrrolo[2,3-c]pyridine);tris(2H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine?
The canonical SMILES for tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;5H-cyclopenta[c]pyridine;furo[2,3-b]pyrazine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-c]pyridine;tris(2H-pyrrolo[2,3-c]pyridine);tris(2H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine is C1=Cc2cnccc2C1.C1=Cc2nnccc2C1.C1=Nc2cnccc2C1.C1=c2ccncc2=NC1.C1=c2ccncc2=NC1.C1=c2ccncc2=NC1.C1=c2cnccc2=NC1.C1=c2cnccc2=NC1.C1=c2cnccc2=NC1.C1=c2nccnc2=CC1.C1=c2nccnc2=CC1.C1=c2nccnc2=CC1.c1cc2cc[nH]c2cn1.c1cc2ccoc2cn1.c1cc2ccsc2cn1.c1cc2ncoc2cn1.c1cc2ncsc2cn1.c1cc2occc2cn1.c1cc2ocnc2cn1.c1cc2sccc2cn1.c1cc2scnc2cn1.c1cnc2[nH]ccc2n1.c1cnc2occc2n1.c1cnc2sccc2n1.
What is the InChIKey of tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;5H-cyclopenta[c]pyridine;furo[2,3-b]pyrazine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-c]pyridine;tris(2H-pyrrolo[2,3-c]pyridine);tris(2H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine?
The InChIKey is RKMYPESDXNTXQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N.12C7H6N2.2C7H5NO.2C7H5NS.C6H5N3.3C6H4N2O.3C6H4N2S/c1-2-7-4-5-9-6-8(7)3-1;3*1-4-9-7-2-3-8-5-6(1)7;5*1-3-8-5-7-6(1)2-4-9-7;3*1-2-6-7(3-1)9-5-4-8-6;1-2-6-4-5-8-9-7(6)3-1;1-3-8-5-6-2-4-9-7(1)6;1-3-8-5-7-6(1)2-4-9-7;1-3-8-5-6-2-4-9-7(1)6;1-3-8-5-7-6(1)2-4-9-7;1-2-8-6-5(1)7-3-4-9-6;1-4-9-6-5(1)7-2-3-8-6;1-2-7-3-5-6(1)9-4-8-5;1-2-7-3-6-5(1)8-4-9-6;1-4-9-6-5(1)7-2-3-8-6;1-2-7-3-5-6(1)9-4-8-5;1-2-7-3-6-5(1)8-4-9-6/h1,3-6H,2H2;3*1-3,5H,4H2;1,3-5H,2H2;3*1-3,5H,4H2;1-5,9H;3*2-5H,1H2;1,3-5H,2H2;4*1-5H;1-4H,(H,8,9);6*1-4H.
What are the key properties of tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;5H-cyclopenta[c]pyridine;furo[2,3-b]pyrazine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-c]pyridine;tris(2H-pyrrolo[2,3-c]pyridine);tris(2H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine?
tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;5H-cyclopenta[c]pyridine;furo[2,3-b]pyrazine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-c]pyridine;tris(2H-pyrrolo[2,3-c]pyridine);tris(2H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine has a molecular weight of 2931.44 g/mol, XLogP of 18.84, 0 rotatable bonds, 2 hydrogen bond donors, and 52 hydrogen bond acceptors.
Where does this data come from?
All data for tris(6H-cyclopenta[b]pyrazine);5H-cyclopenta[c]pyridazine;5H-cyclopenta[c]pyridine;furo[2,3-b]pyrazine;furo[2,3-c]pyridine;furo[3,2-c]pyridine;[1,3]oxazolo[4,5-c]pyridine;[1,3]oxazolo[5,4-c]pyridine;5H-pyrrolo[2,3-b]pyrazine;1H-pyrrolo[2,3-c]pyridine;tris(2H-pyrrolo[2,3-c]pyridine);tris(2H-pyrrolo[3,2-c]pyridine);3H-pyrrolo[2,3-c]pyridine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridine;thieno[3,2-c]pyridine is sourced from PubChem (CID 160651720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).