6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,7-naphthyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;quinazoline;quinoxaline;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine

C83H82N26OS — CID 157249469

IUPAC6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,7-naphthyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;quinazoline;quinoxaline;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
SMILESC1=NCC2=C1CCCC2.c1cc2n(n1)CCCC2.c1cc2n(n1)CCOC2.c1ccc2[nH]ncc2c1.c1ccc2nccnc2c1.c1ccc2ncncc2c1.c1cn2ccsc2n1.c1cnc2ccnn2c1.c1cnc2cnccc2c1.c1cnc2nccnc2c1.c1cnn2nccc2c1.c1ncn2c1CCCC2
InChIInChI=1S/3C8H6N2.C8H11N.C7H5N3.2C7H10N2.C7H6N2.2C6H5N3.C6H8N2O.C5H4N2S/c1-2-7-3-5-9-6-8(7)10-4-1;1-2-4-8-7(3-1)5-9-6-10-8;1-2-4-8-7(3-1)9-5-6-10-8;1-2-4-8-6-9-5-7(8)3-1;1-2-6-7(9-3-1)10-5-4-8-6;1-2-6-9-7(3-1)4-5-8-9;1-2-4-9-6-8-5-7(9)3-1;1-2-4-7-6(3-1)5-8-9-7;1-3-7-6-2-4-8-9(6)5-1;1-2-6-3-5-8-9(6)7-4-1;1-2-7-8-3-4-9-5-6(1)8;1-2-7-3-4-8-5(7)6-1/h3*1-6H;5H,1-4,6H2;1-5H;4-5H,1-3,6H2;5-6H,1-4H2;1-5H,(H,8,9);2*1-5H;1-2H,3-5H2;1-4H
InChIKeyAWECGXSKDRAXRW-UHFFFAOYSA-N
MW1491.82 g/mol
LogP15.12
Rot. Bonds

About 6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,7-naphthyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;quinazoline;quinoxaline;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine

6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,7-naphthyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;quinazoline;quinoxaline;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine (PubChem CID 157249469) has the molecular formula C83H82N26OS and a molecular weight of 1491.82 g/mol. Its IUPAC name is 6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,7-naphthyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;quinazoline;quinoxaline;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,7-naphthyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;quinazoline;quinoxaline;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
PubChem CID157249469
Molecular FormulaC83H82N26OS
Molecular Weight1491.82 g/mol
Exact Mass1490.69
IUPAC Name6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,7-naphthyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;quinazoline;quinoxaline;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
SMILESC1=NCC2=C1CCCC2.c1cc2n(n1)CCCC2.c1cc2n(n1)CCOC2.c1ccc2[nH]ncc2c1.c1ccc2nccnc2c1.c1ccc2ncncc2c1.c1cn2ccsc2n1.c1cnc2ccnn2c1.c1cnc2cnccc2c1.c1cnc2nccnc2c1.c1cnn2nccc2c1.c1ncn2c1CCCC2
InChIInChI=1S/3C8H6N2.C8H11N.C7H5N3.2C7H10N2.C7H6N2.2C6H5N3.C6H8N2O.C5H4N2S/c1-2-7-3-5-9-6-8(7)10-4-1;1-2-4-8-7(3-1)5-9-6-10-8;1-2-4-8-7(3-1)9-5-6-10-8;1-2-4-8-6-9-5-7(8)3-1;1-2-6-7(9-3-1)10-5-4-8-6;1-2-6-9-7(3-1)4-5-8-9;1-2-4-9-6-8-5-7(9)3-1;1-2-4-7-6(3-1)5-8-9-7;1-3-7-6-2-4-8-9(6)5-1;1-2-6-3-5-8-9(6)7-4-1;1-2-7-8-3-4-9-5-6(1)8;1-2-7-3-4-8-5(7)6-1/h3*1-6H;5H,1-4,6H2;1-5H;4-5H,1-3,6H2;5-6H,1-4H2;1-5H,(H,8,9);2*1-5H;1-2H,3-5H2;1-4H
InChIKeyAWECGXSKDRAXRW-UHFFFAOYSA-N
XLogP15.12
TPSA297.42 Ų
H-Bond Donors1
H-Bond Acceptors27
Rotatable Bonds
Heavy Atoms111
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001491.82
LogP ≤ 515.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1027

Analyze 6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,7-naphthyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;quinazoline;quinoxaline;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine with MolForge

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Related Compounds

bis(1H-benzimidazole);5-(1,1-difluoroethyl)-1H-pyrazole;2-(1,1-difluoroethyl)pyridine;3-(1,1-difluoroethyl)pyridine;4-(1,1-difluoroethyl)pyridine;N,N-dimethylpyridin-3-amine;2,3-dimethylpyridine;3,5-dimethylpyridine;N,N-dimethylpyrimidin-2-amine;2-ethyl-6-methoxypyridine;N-ethynyl-2-pyridin-4-ylethanamine;2-fluoro-3-methylpyridine;4-fluoropyridine;imidazo[1,2-a]pyridine;2H-indene;bis(1H-indole);2-methylpyridine;bis(3-methylpyridine);2-piperidin-1-ylpyridine;3-piperidin-1-ylpyridine;pyrazine;bis(pyridine);pyrimidine;2-pyrrolidin-1-yl-1,3-thiazole;1H-pyrrolo[3,2-b]pyridine;[1,2,4]triazolo[1,5-a]pyridine
CID 158030834
1H-benzimidazole;2,6-dimethoxypyridine;N,N-dimethylpyrimidin-2-amine;imidazo[1,2-a]pyridine;1H-indazole;1H-indole;2H-isoindole;pyrazine;pyridazine;pyridine;2-pyridin-4-ylethylcyanamide;4-pyridin-2-ylmorpholine;4-pyridin-3-ylmorpholine;pyrimidine;2-pyrrolidin-1-yl-1,3-thiazole;1H-pyrrolo[3,2-b]pyridine;[1,2,4]triazolo[1,5-a]pyridine;5-(trifluoromethyl)-1H-pyrazole;2-(trifluoromethyl)pyridine;3-(trifluoromethyl)pyridine;4-(trifluoromethyl)pyridine
CID 158043085
1H-benzimidazole;5-(1,1-difluoroethyl)-1H-pyrazole;N,N-dimethylpyrimidin-2-amine;2-ethyl-6-methoxypyridine;N-ethynyl-2-pyridin-4-ylethanamine;imidazo[1,2-a]pyridine;2H-indene;bis(1H-indole);2-piperidin-1-ylpyridine;3-piperidin-1-ylpyridine;pyrazine;bis(pyridine);pyrimidine;2-pyrrolidin-1-yl-1,3-thiazole;1H-pyrrolo[3,2-b]pyridine;[1,2,4]triazolo[1,5-a]pyridine;2-(trifluoromethyl)pyridine;3-(trifluoromethyl)pyridine
CID 159652200
2-[5-(1H-benzimidazol-2-yl)-5-(1H-imidazol-2-yl)-6-(1H-indazol-3-yl)-7-(1H-indol-2-yl)-2-pyrazin-2-yl-6-(1H-pyrazol-3-yl)-1-pyridazin-3-yl-3a-pyridin-2-yl-3-pyrimidin-2-yl-7a-(1H-pyrrol-2-yl)-3-quinoxalin-2-yl-4-(1H-1,2,4-triazol-3-yl)pyrazolo[4,3-b]pyridin-7-yl]-1,3-thiazole
CID 141290187
6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;bis(imidazo[1,5-b]pyridazine);1H-indazole;1,6-naphthyridine;1,7-naphthyridine;2,6-naphthyridine;2,7-naphthyridine;pyrazolo[1,5-c]pyrimidine;pyrimido[5,4-d]pyrimidine;1H-pyrrolo[3,4-c]pyridine;3H-pyrrolo[3,4-c]pyridine;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 157127848
1H-benzimidazole;1,3-benzothiazole;imidazo[1,2-a]pyridine;6-methylidene-1H-pyridazine;2-methylidene-1H-pyridine;morpholine;pyrazine;pyrazolo[1,5-a]pyridine;bis(pyridine);pyrimidine;quinoline;quinoxaline;1,3,5-triazine;[1,2,4]triazolo[1,5-a]pyridine;[1,2,4]triazolo[4,3-a]pyridine
CID 157497115
3-methylpyrazolo[1,5-b]pyridazine;1-propan-2-ylbenzimidazole;4-propan-2-yl-7H-cyclopenta[b]pyridine;3-propan-2-ylimidazo[1,2-a]pyridine;3-propan-2-ylimidazo[1,2-b]pyridazine;5-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-ylpyrazolo[1,5-a]pyrazine;3-propan-2-ylpyrazolo[1,5-a]pyridine;3-propan-2-ylpyrazolo[1,5-a]pyrimidine;7-propan-2-ylpyrazolo[5,1-b][1,3]thiazole;3-propan-2-ylpyrazolo[1,5-c]pyrimidine;4-propan-2-ylquinoline;3-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;4-propan-2-ylthieno[2,3-b]pyridine;7-propan-2-ylthieno[3,2-b]pyridine;3-propan-2-yl-2H-[1,2,4]triazolo[4,3-a]pyridin-4-ium
CID 157508732
cinnoline;6,8-dihydro-5H-imidazo[5,1-c][1,4]oxazine;imidazo[1,5-a]pyrazine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,6-naphthyridine;bis(1,7-naphthyridine);2,6-naphthyridine;2,7-naphthyridine;phthalazine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;pyrimido[5,4-d]pyrimidine;1H-pyrrolo[3,4-c]pyridine;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 157739299
1H-imidazo[4,5-b]pyridine;2-methylpropane;2-propan-2-yl-1H-benzimidazole;2-propan-2-yl-6,7-dihydro-5H-pyrazolo[5,1-b][1,3]oxazine;2-propan-2-ylimidazo[1,2-a]pyridine;6-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-ylpyridazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;2-propan-2-yl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine;3-propan-2-yl-4,5,6,7-tetrahydro-1H-indazole;3-propan-2-yl-1,4,6,7-tetrahydropyrano[4,3-c]pyrazole
CID 158265747
2-tert-butyl-1-methylimidazole;5-tert-butyl-1-methylimidazole;3-tert-butyl-1-methylindazole;2-tert-butyl-6-methylpyridine;3-tert-butyl-4-methylpyridine;4-tert-butyl-1-methyltriazole;2-tert-butyl-1-oxidopyridin-1-ium;2-tert-butylpyrazine;5-tert-butyl-1H-pyrazole;2-tert-butylpyridine;4-(5-tert-butyl-2-pyridinyl)morpholine;2-tert-butylpyrimidine;4-tert-butylpyrimidine;2-tert-butyl-1,3-thiazole
CID 158419542
6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[1,2-a]pyrimidine;imidazo[1,2-b]pyridazine;imidazo[1,5-b]pyridazine;1H-indazole;1,6-naphthyridine;1,7-naphthyridine;2,6-naphthyridine;2,7-naphthyridine;pyrazolo[1,5-c]pyrimidine;pyrimido[5,4-d]pyrimidine;1H-pyrrolo[3,4-c]pyridine;3H-pyrrolo[3,4-c]pyridine;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine
CID 158433535
3-methylpyrazolo[1,5-b]pyridazine;1-propan-2-ylbenzimidazole;4-propan-2-yl-7H-cyclopenta[b]pyridine;3-propan-2-ylimidazo[1,2-a]pyridine;3-propan-2-ylimidazo[1,2-b]pyridazine;5-propan-2-ylimidazo[2,1-b][1,3]thiazole;3-propan-2-yl-2H-indazole;3-propan-2-ylpyrazolo[1,5-a]pyrazine;3-propan-2-ylpyrazolo[1,5-a]pyridine;3-propan-2-ylpyrazolo[1,5-a]pyrimidine;7-propan-2-ylpyrazolo[5,1-b][1,3]thiazole;3-propan-2-ylpyrazolo[1,5-c]pyrimidine;4-propan-2-ylquinoline;3-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine;4-propan-2-ylthieno[2,3-b]pyridine;7-propan-2-ylthieno[3,2-b]pyridine
CID 158912185

Frequently Asked Questions

What is the IUPAC name of 6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,7-naphthyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;quinazoline;quinoxaline;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
The IUPAC name of 6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,7-naphthyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;quinazoline;quinoxaline;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine (CID 157249469) is 6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,7-naphthyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;quinazoline;quinoxaline;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine.
What is the SMILES notation for 6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,7-naphthyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;quinazoline;quinoxaline;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
The canonical SMILES for 6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,7-naphthyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;quinazoline;quinoxaline;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine is C1=NCC2=C1CCCC2.c1cc2n(n1)CCCC2.c1cc2n(n1)CCOC2.c1ccc2[nH]ncc2c1.c1ccc2nccnc2c1.c1ccc2ncncc2c1.c1cn2ccsc2n1.c1cnc2ccnn2c1.c1cnc2cnccc2c1.c1cnc2nccnc2c1.c1cnn2nccc2c1.c1ncn2c1CCCC2.
What is the InChIKey of 6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,7-naphthyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;quinazoline;quinoxaline;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
The InChIKey is AWECGXSKDRAXRW-UHFFFAOYSA-N. The full InChI is InChI=1S/3C8H6N2.C8H11N.C7H5N3.2C7H10N2.C7H6N2.2C6H5N3.C6H8N2O.C5H4N2S/c1-2-7-3-5-9-6-8(7)10-4-1;1-2-4-8-7(3-1)5-9-6-10-8;1-2-4-8-7(3-1)9-5-6-10-8;1-2-4-8-6-9-5-7(8)3-1;1-2-6-7(9-3-1)10-5-4-8-6;1-2-6-9-7(3-1)4-5-8-9;1-2-4-9-6-8-5-7(9)3-1;1-2-4-7-6(3-1)5-8-9-7;1-3-7-6-2-4-8-9(6)5-1;1-2-6-3-5-8-9(6)7-4-1;1-2-7-8-3-4-9-5-6(1)8;1-2-7-3-4-8-5(7)6-1/h3*1-6H;5H,1-4,6H2;1-5H;4-5H,1-3,6H2;5-6H,1-4H2;1-5H,(H,8,9);2*1-5H;1-2H,3-5H2;1-4H.
What are the key properties of 6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,7-naphthyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;quinazoline;quinoxaline;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine?
6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,7-naphthyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;quinazoline;quinoxaline;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine has a molecular weight of 1491.82 g/mol, XLogP of 15.12, 0 rotatable bonds, 1 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dihydro-4H-pyrazolo[5,1-c][1,4]oxazine;imidazo[2,1-b][1,3]thiazole;1H-indazole;1,7-naphthyridine;pyrazolo[1,5-a]pyrimidine;pyrazolo[1,5-b]pyridazine;pyrido[2,3-b]pyrazine;quinazoline;quinoxaline;5,6,7,8-tetrahydroimidazo[1,5-a]pyridine;4,5,6,7-tetrahydro-1H-isoindole;4,5,6,7-tetrahydropyrazolo[1,5-a]pyridine is sourced from PubChem (CID 157249469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).