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

C102H128N32 — CID 161122039

IUPACacridine;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
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.c1cc2nccn2cn1.c1ccc2c(c1)ccc1nccn12.c1ccc2cn3ccnc3cc2c1.c1ccc2nc3ccccc3cc2c1.c1ccn2ccnc2c1.c1cn2ccnc2cn1.c1cn2ccnc2nn1.c1cn2cncnc2n1.c1cn2ncncc2n1.c1cnn2ccnc2c1.c1cnn2ccnc2n1
InChIInChI=1S/C13H9N.2C11H8N2.C7H6N2.3C6H5N3.4C5H4N4.11C2H6/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12;1-2-4-10-8-13-6-5-12-11(13)7-9(10)3-1;1-2-4-10-9(3-1)5-6-11-12-7-8-13(10)11;1-2-5-9-6-4-8-7(9)3-1;1-3-9-4-2-8-6(9)5-7-1;1-2-7-5-9-4-3-8-6(1)9;1-2-6-7-4-5-9(6)8-3-1;1-3-9-4-2-7-8-5(9)6-1;1-2-9-4-6-3-8-5(9)7-1;1-2-9-5(7-1)3-6-4-8-9;1-2-8-9-4-3-7-5(9)6-1;11*1-2/h1-9H;2*1-8H;1-6H;3*1-5H;4*1-4H;11*1-2H3
InChIKeyULBQOTFJGYUZQY-UHFFFAOYSA-N
MW1802.37 g/mol
LogP23.67
Rot. Bonds

About 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

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 (PubChem CID 161122039) has the molecular formula C102H128N32 and a molecular weight of 1802.37 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Nameacridine;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
PubChem CID161122039
Molecular FormulaC102H128N32
Molecular Weight1802.37 g/mol
Exact Mass1801.10
IUPAC Nameacridine;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
SMILESCC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.c1cc2nccn2cn1.c1ccc2c(c1)ccc1nccn12.c1ccc2cn3ccnc3cc2c1.c1ccc2nc3ccccc3cc2c1.c1ccn2ccnc2c1.c1cn2ccnc2cn1.c1cn2ccnc2nn1.c1cn2cncnc2n1.c1cn2ncncc2n1.c1cnn2ccnc2c1.c1cnn2ccnc2n1
InChIInChI=1S/C13H9N.2C11H8N2.C7H6N2.3C6H5N3.4C5H4N4.11C2H6/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12;1-2-4-10-8-13-6-5-12-11(13)7-9(10)3-1;1-2-4-10-9(3-1)5-6-11-12-7-8-13(10)11;1-2-5-9-6-4-8-7(9)3-1;1-3-9-4-2-8-6(9)5-7-1;1-2-7-5-9-4-3-8-6(1)9;1-2-6-7-4-5-9(6)8-3-1;1-3-9-4-2-7-8-5(9)6-1;1-2-9-4-6-3-8-5(9)7-1;1-2-9-5(7-1)3-6-4-8-9;1-2-8-9-4-3-7-5(9)6-1;11*1-2/h1-9H;2*1-8H;1-6H;3*1-5H;4*1-4H;11*1-2H3
InChIKeyULBQOTFJGYUZQY-UHFFFAOYSA-N
XLogP23.67
TPSA327.68 Ų
H-Bond Donors
H-Bond Acceptors32
Rotatable Bonds
Heavy Atoms134
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001802.37
LogP ≤ 523.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1032

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Analyze 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 with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

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
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
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
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;imidazo[1,2-a]quinoline
CID 123314121
1,3-benzothiazole;1,3-benzoxazole;ethane;imidazo[1,2-a]pyrazine;bis(imidazo[1,2-a]pyridine);imidazo[1,2-a]pyrimidine;isoquinoline;1-methylbenzimidazole;1-methylimidazo[4,5-b]pyridine;2-methylindazole;bis(1-methylindole);2-methylisoindole;2-methylpyrazolo[3,4-b]pyridine;1-methylpyrrolo[2,3-b]pyridine;1-methylpyrrolo[3,2-b]pyridine;naphthalene;1,5-naphthyridine;1,7-naphthyridine;1,8-naphthyridine;[1,3]oxazolo[4,5-c]pyridine;1-propan-2-ylbenzimidazole;pyrazolo[1,5-a]pyridine;pyrido[2,3-c]pyridazine;pyrido[3,2-d]pyrimidine;quinazoline;quinoline;quinoxaline;[1,3]thiazolo[4,5-b]pyridine;[1,2,4]triazolo[1,5-a]pyrazine;[1,2,4]triazolo[1,5-a]pyridine;[1,2,4]triazolo[1,5-a]pyrimidine
CID 163949208
6,7-dihydro-5H-cyclopenta[b]pyridine;imidazo[1,2-a]pyridine;imidazo[1,2-b]pyridazine;pyrazolo[1,5-a]pyrimidine;pyrazolo[5,1-c][1,2,4]triazine;[1,2,4]triazolo[1,5-a]pyrimidine;[1,2,4]triazolo[1,5-b]pyridazine
CID 161139951
carbanide;ethane;imidazo[1,2-a]pyridine;imidazo[1,2-a]pyrimidine;bis(yttrium)
CID 159110066
cinnoline;imidazo[1,2-c]pyrimidine;isoquinoline;1,5-naphthyridine;1,6-naphthyridine;1,7-naphthyridine;1,8-naphthyridine;2,6-naphthyridine;2,7-naphthyridine;phthalazine;pyrazino[2,3-b]pyrazine;pyrido[2,3-b]pyrazine;pyrido[3,4-b]pyrazine;pyrido[2,3-d]pyrimidine;pyrido[3,2-d]pyrimidine;pyrido[3,4-d]pyrimidine;pyrido[4,3-d]pyrimidine;pyrimido[4,5-d]pyrimidine;pyrimido[5,4-d]pyrimidine;quinazoline;quinoline;quinoxaline
CID 162065548
2H-imidazo[4,5-b]pyridine;2H-imidazo[4,5-c]pyridine;bis(pyrazolo[1,5-a][1,3,5]triazine);bis(pyrazolo[1,5-b][1,2,4]triazine);bis(pyrazolo[1,5-c]triazine);bis(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][1,3,5]triazine;pyrrolo[2,1-c][1,2,4]triazine;[1,3]thiazolo[4,5-b]pyrazine;[1,3]thiazolo[4,5-b]pyridine;[1,3]thiazolo[5,4-b]pyridine;[1,3]thiazolo[4,5-c]pyridazine;[1,3]thiazolo[5,4-c]pyridazine;[1,3]thiazolo[4,5-c]pyridine;[1,3]thiazolo[5,4-c]pyridine;[1,3]thiazolo[4,5-d]pyridazine;[1,3]thiazolo[4,5-d]pyrimidine;[1,3]thiazolo[5,4-d]pyrimidine;thieno[2,3-b]pyrazine;thieno[2,3-c]pyridazine;thieno[3,2-c]pyridazine;thieno[2,3-d]pyridazine;thieno[2,3-d]pyrimidine;thieno[3,2-d]pyrimidine;[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 162193295
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
imidazo[2,1-f][1,2,4]triazine;hydrochloride
CID 129057469

Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.CC.c1cc2nccn2cn1.c1ccc2c(c1)ccc1nccn12.c1ccc2cn3ccnc3cc2c1.c1ccc2nc3ccccc3cc2c1.c1ccn2ccnc2c1.c1cn2ccnc2cn1.c1cn2ccnc2nn1.c1cn2cncnc2n1.c1cn2ncncc2n1.c1cnn2ccnc2c1.c1cnn2ccnc2n1.
What is the InChIKey of 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?
The InChIKey is ULBQOTFJGYUZQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N.2C11H8N2.C7H6N2.3C6H5N3.4C5H4N4.11C2H6/c1-3-7-12-10(5-1)9-11-6-2-4-8-13(11)14-12;1-2-4-10-8-13-6-5-12-11(13)7-9(10)3-1;1-2-4-10-9(3-1)5-6-11-12-7-8-13(10)11;1-2-5-9-6-4-8-7(9)3-1;1-3-9-4-2-8-6(9)5-7-1;1-2-7-5-9-4-3-8-6(1)9;1-2-6-7-4-5-9(6)8-3-1;1-3-9-4-2-7-8-5(9)6-1;1-2-9-4-6-3-8-5(9)7-1;1-2-9-5(7-1)3-6-4-8-9;1-2-8-9-4-3-7-5(9)6-1;11*1-2/h1-9H;2*1-8H;1-6H;3*1-5H;4*1-4H;11*1-2H3.
What are the key properties of 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?
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 has a molecular weight of 1802.37 g/mol, XLogP of 23.67, 0 rotatable bonds, 0 hydrogen bond donors, and 32 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 161122039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).