2-methylcyclopenta-1,3-diene;2-methylfuran;2-methyl-4H-imidazole;5-methyl-4H-imidazole;3-methyl-1,2-oxazole;2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-3H-pyrrole;3-methyl-2H-pyrrole;4-methyl-2H-pyrrole;4-methyl-3H-pyrrole;5-methyl-2H-pyrrole;5-methyl-3H-pyrrole;3-methyl-1,2,4,5-tetrazine;2-methyl-1,3,4-thiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;5-methylthiatriazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;2-methyl-1,3,5-triazine;5-methyl-3H-1,2,4-triazole;5-methyl-4H-triazole

C147H191N51O2S9 — CID 158756166

IUPAC2-methylcyclopenta-1,3-diene;2-methylfuran;2-methyl-4H-imidazole;5-methyl-4H-imidazole;3-methyl-1,2-oxazole;2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-3H-pyrrole;3-methyl-2H-pyrrole;4-methyl-2H-pyrrole;4-methyl-3H-pyrrole;5-methyl-2H-pyrrole;5-methyl-3H-pyrrole;3-methyl-1,2,4,5-tetrazine;2-methyl-1,3,4-thiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;5-methylthiatriazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;2-methyl-1,3,5-triazine;5-methyl-3H-1,2,4-triazole;5-methyl-4H-triazole
SMILESCC1=CC=NC1.CC1=CCC=C1.CC1=CCC=N1.CC1=CCN=C1.CC1=CN=CC1.CC1=NC=CC1.CC1=NC=NC1.CC1=NCC=C1.CC1=NCC=N1.CC1=NCN=N1.CC1=NN=NC1.Cc1ccccn1.Cc1cccnc1.Cc1cccnn1.Cc1ccco1.Cc1cccs1.Cc1ccncc1.Cc1ccncn1.Cc1ccnnc1.Cc1ccon1.Cc1ccsc1.Cc1cnccn1.Cc1cncnc1.Cc1cncs1.Cc1cnns1.Cc1cscn1.Cc1ncccn1.Cc1nccs1.Cc1ncncn1.Cc1ncns1.Cc1nncnn1.Cc1nncs1.Cc1nnns1
InChIInChI=1S/3C6H7N.C6H8.6C5H6N2.6C5H7N.C5H6O.2C5H6S.C4H5N3.2C4H6N2.C4H5NO.3C4H5NS.C3H4N4.2C3H5N3.3C3H4N2S.C2H3N3S/c1-6-2-4-7-5-3-6;1-6-3-2-4-7-5-6;1-6-4-2-3-5-7-6;1-6-4-2-3-5-6;1-5-2-6-4-7-3-5;1-5-4-6-2-3-7-5;1-5-2-3-6-4-7-5;1-5-2-3-6-7-4-5;1-5-6-3-2-4-7-5;1-5-3-2-4-6-7-5;3*1-5-2-3-6-4-5;4*1-5-3-2-4-6-5;1-5-2-3-6-4-5;1-5-3-2-4-6-5;1-4-6-2-5-3-7-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-4-2-3-6-5-4;1-4-2-6-3-5-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-3-6-4-2-5-7-3;1-3-4-2-5-6-3;1-3-2-4-6-5-3;1-3-5-4-2-6-3;1-3-4-2-5-6-3;1-3-2-4-5-6-3;1-2-3-4-5-6-2/h3*2-5H,1H3;2,4-5H,3H2,1H3;6*2-4H,1H3;3-4H,2H2,1H3;2,4H,3H2,1H3;2-3H,4H2,1H3;3-4H,2H2,1H3;2,4H,3H2,1H3;2-3H,4H2,1H3;3*2-4H,1H3;2-3H,1H3;3H,2H2,1H3;2H,3H2,1H3;4*2-3H,1H3;2H,1H3;2*2H2,1H3;3*2H,1H3;1H3
InChIKeyIOCJJIHBFNORCJ-UHFFFAOYSA-N
MW2993.10 g/mol
LogP34.13
Rot. Bonds

About 2-methylcyclopenta-1,3-diene;2-methylfuran;2-methyl-4H-imidazole;5-methyl-4H-imidazole;3-methyl-1,2-oxazole;2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-3H-pyrrole;3-methyl-2H-pyrrole;4-methyl-2H-pyrrole;4-methyl-3H-pyrrole;5-methyl-2H-pyrrole;5-methyl-3H-pyrrole;3-methyl-1,2,4,5-tetrazine;2-methyl-1,3,4-thiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;5-methylthiatriazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;2-methyl-1,3,5-triazine;5-methyl-3H-1,2,4-triazole;5-methyl-4H-triazole

2-methylcyclopenta-1,3-diene;2-methylfuran;2-methyl-4H-imidazole;5-methyl-4H-imidazole;3-methyl-1,2-oxazole;2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-3H-pyrrole;3-methyl-2H-pyrrole;4-methyl-2H-pyrrole;4-methyl-3H-pyrrole;5-methyl-2H-pyrrole;5-methyl-3H-pyrrole;3-methyl-1,2,4,5-tetrazine;2-methyl-1,3,4-thiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;5-methylthiatriazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;2-methyl-1,3,5-triazine;5-methyl-3H-1,2,4-triazole;5-methyl-4H-triazole (PubChem CID 158756166) has the molecular formula C147H191N51O2S9 and a molecular weight of 2993.10 g/mol. Its IUPAC name is 2-methylcyclopenta-1,3-diene;2-methylfuran;2-methyl-4H-imidazole;5-methyl-4H-imidazole;3-methyl-1,2-oxazole;2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-3H-pyrrole;3-methyl-2H-pyrrole;4-methyl-2H-pyrrole;4-methyl-3H-pyrrole;5-methyl-2H-pyrrole;5-methyl-3H-pyrrole;3-methyl-1,2,4,5-tetrazine;2-methyl-1,3,4-thiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;5-methylthiatriazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;2-methyl-1,3,5-triazine;5-methyl-3H-1,2,4-triazole;5-methyl-4H-triazole.

Molecular Properties

Compound Name2-methylcyclopenta-1,3-diene;2-methylfuran;2-methyl-4H-imidazole;5-methyl-4H-imidazole;3-methyl-1,2-oxazole;2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-3H-pyrrole;3-methyl-2H-pyrrole;4-methyl-2H-pyrrole;4-methyl-3H-pyrrole;5-methyl-2H-pyrrole;5-methyl-3H-pyrrole;3-methyl-1,2,4,5-tetrazine;2-methyl-1,3,4-thiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;5-methylthiatriazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;2-methyl-1,3,5-triazine;5-methyl-3H-1,2,4-triazole;5-methyl-4H-triazole
PubChem CID158756166
Molecular FormulaC147H191N51O2S9
Molecular Weight2993.10 g/mol
Exact Mass2990.39
IUPAC Name2-methylcyclopenta-1,3-diene;2-methylfuran;2-methyl-4H-imidazole;5-methyl-4H-imidazole;3-methyl-1,2-oxazole;2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-3H-pyrrole;3-methyl-2H-pyrrole;4-methyl-2H-pyrrole;4-methyl-3H-pyrrole;5-methyl-2H-pyrrole;5-methyl-3H-pyrrole;3-methyl-1,2,4,5-tetrazine;2-methyl-1,3,4-thiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;5-methylthiatriazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;2-methyl-1,3,5-triazine;5-methyl-3H-1,2,4-triazole;5-methyl-4H-triazole
SMILESCC1=CC=NC1.CC1=CCC=C1.CC1=CCC=N1.CC1=CCN=C1.CC1=CN=CC1.CC1=NC=CC1.CC1=NC=NC1.CC1=NCC=C1.CC1=NCC=N1.CC1=NCN=N1.CC1=NN=NC1.Cc1ccccn1.Cc1cccnc1.Cc1cccnn1.Cc1ccco1.Cc1cccs1.Cc1ccncc1.Cc1ccncn1.Cc1ccnnc1.Cc1ccon1.Cc1ccsc1.Cc1cnccn1.Cc1cncnc1.Cc1cncs1.Cc1cnns1.Cc1cscn1.Cc1ncccn1.Cc1nccs1.Cc1ncncn1.Cc1ncns1.Cc1nncnn1.Cc1nncs1.Cc1nnns1
InChIInChI=1S/3C6H7N.C6H8.6C5H6N2.6C5H7N.C5H6O.2C5H6S.C4H5N3.2C4H6N2.C4H5NO.3C4H5NS.C3H4N4.2C3H5N3.3C3H4N2S.C2H3N3S/c1-6-2-4-7-5-3-6;1-6-3-2-4-7-5-6;1-6-4-2-3-5-7-6;1-6-4-2-3-5-6;1-5-2-6-4-7-3-5;1-5-4-6-2-3-7-5;1-5-2-3-6-4-7-5;1-5-2-3-6-7-4-5;1-5-6-3-2-4-7-5;1-5-3-2-4-6-7-5;3*1-5-2-3-6-4-5;4*1-5-3-2-4-6-5;1-5-2-3-6-4-5;1-5-3-2-4-6-5;1-4-6-2-5-3-7-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-4-2-3-6-5-4;1-4-2-6-3-5-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-3-6-4-2-5-7-3;1-3-4-2-5-6-3;1-3-2-4-6-5-3;1-3-5-4-2-6-3;1-3-4-2-5-6-3;1-3-2-4-5-6-3;1-2-3-4-5-6-2/h3*2-5H,1H3;2,4-5H,3H2,1H3;6*2-4H,1H3;3-4H,2H2,1H3;2,4H,3H2,1H3;2-3H,4H2,1H3;3-4H,2H2,1H3;2,4H,3H2,1H3;2-3H,4H2,1H3;3*2-4H,1H3;2-3H,1H3;3H,2H2,1H3;2H,3H2,1H3;4*2-3H,1H3;2H,1H3;2*2H2,1H3;3*2H,1H3;1H3
InChIKeyIOCJJIHBFNORCJ-UHFFFAOYSA-N
XLogP34.13
TPSA675.19 Ų
H-Bond Donors
H-Bond Acceptors62
Rotatable Bonds
Heavy Atoms209
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002993.10
LogP ≤ 534.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1062

Analyze 2-methylcyclopenta-1,3-diene;2-methylfuran;2-methyl-4H-imidazole;5-methyl-4H-imidazole;3-methyl-1,2-oxazole;2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-3H-pyrrole;3-methyl-2H-pyrrole;4-methyl-2H-pyrrole;4-methyl-3H-pyrrole;5-methyl-2H-pyrrole;5-methyl-3H-pyrrole;3-methyl-1,2,4,5-tetrazine;2-methyl-1,3,4-thiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;5-methylthiatriazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;2-methyl-1,3,5-triazine;5-methyl-3H-1,2,4-triazole;5-methyl-4H-triazole 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

3-Chloro-2-methylthiophene;2,3-dimethylfuran;4,5-dimethyl-2-phenyltriazole;1,2-dimethylpyrrole;4,5-dimethylthiadiazole;1,4-dimethyl-3-(trifluoromethyl)pyrazole;2,3-dimethyl-4-(trifluoromethyl)pyridine;5-methyl-1,2-oxazole;2-methylpyrazine;5-methyl-4-(trifluoromethyl)pyrimidine;1,4,5-trimethylimidazole
CID 158002845
5-tert-butyl-2,3-dimethylfuran;3-tert-butyl-1,5-dimethylpyrazole;3-tert-butyl-4,5-dimethyl-1,2,4-triazole;3-tert-butyl-5-methyl-1,2-oxazole;5-tert-butyl-3-methyl-1,2-oxazole;3-tert-butyl-5-methyl-1H-pyrazole;2-tert-butyl-4-methylpyridine;4-tert-butyl-6-methylpyrimidine;2-tert-butyl-5-methyl-1,3,4-thiadiazole;3-tert-butyl-5-methyl-1,2,4-thiadiazole;4-tert-butyl-2-methyl-1,3-thiazole;4,5-dimethyl-1-propan-2-ylpyrazole;3-(2,2-dimethylpropyl)-5-methyl-1,2-oxazole;3-(2-fluoropropan-2-yl)-5-methyl-1,2-oxazole;5-methyl-3-(2-methylbutan-2-yl)-1,2-oxazole;3-methyl-5-(2-methylpropyl)-1,2-oxazole;5-methyl-3-propan-2-yl-1,2-oxazole;4-methyl-1-propan-2-ylpyrazole;4-methyl-1-propan-2-yltriazole;5-methyl-3-(trifluoromethyl)-1,2-oxazole;2-methyl-4-(trifluoromethyl)pyridine;2-methyl-5-(trifluoromethyl)-1,3,4-thiadiazole
CID 158832470
2-tert-butyl-5-cyclopropylthiophene;4-tert-butyl-2,5-dimethyl-1,3-thiazole;2-tert-butyl-4-methyl-1,3-thiazole;3-tert-butylpyridine;4-[(4-tert-butylthiophen-2-yl)methyl]morpholine;5-cyclopropyl-3-propan-2-yl-1,2,4-oxadiazole;2-(2,2-difluoropropyl)-4-propan-2-yltriazole;2,4-dimethyl-1-propan-2-ylimidazole;3,4-dimethyl-1-propan-2-ylpyrazole;3,5-dimethyl-1-propan-2-ylpyrazole;2,4-dimethyl-5-propan-2-yl-1,3-thiazole;N,N-dimethyl-1-(1-propan-2-yl-1,2,4-triazol-3-yl)methanamine;3-propan-2-ylfuran;1-propan-2-ylimidazole;4-propan-2-yl-1-propylpyrazole;4-propan-2-ylpyridine;4-propan-2-yl-2H-pyrrole;5-propan-2-yl-2H-pyrrole
CID 158946007
methane;bis(2-propan-2-ylcyclopenta-1,3-diene);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;2-propan-2-ylpyrazine;1-propan-2-ylpyrazole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;3-propan-2-ylpyridazine;4-propan-2-ylpyridazine;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;2-propan-2-ylpyrimidine;4-propan-2-ylpyrimidine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;5-propan-2-yl-2H-pyrrole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;2-propan-2-ylthiophene;1-propan-2-yl-1,2,4-triazole;4-propan-2-yl-1,2,4-triazole;bis(4-propan-2-yl-2H-triazole)
CID 157055801
3-propan-2-ylfuran;5-propan-2-yl-1H-imidazole;3-propan-2-yl-1,2,4-oxadiazole;5-propan-2-yl-1,2,4-oxadiazole;3-propan-2-yl-1,2-oxazole;4-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;4-propan-2-yl-3H-pyrrole;bis(5-propan-2-yl-2H-tetrazole);2-propan-2-yl-1,3,4-thiadiazole;2-propan-2-yl-1,3-thiazole;4-propan-2-yl-1,2-thiazole;4-propan-2-yl-1,3-thiazole;5-propan-2-yl-1,3-thiazole;3-propan-2-ylthiophene
CID 157105191
2,5-dimethylfuran;1,4-dimethylimidazole;bis(3,5-dimethyl-1,2,4-oxadiazole);2,4-dimethyl-1,3-oxazole;bis(2,5-dimethyl-1,3-oxazole);bis(3,5-dimethyl-1,2-oxazole);2,5-dimethylpyrazine;3,5-dimethyl-1H-pyrazole;3,6-dimethylpyridazine;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);2,4-dimethyl-1,3-thiazole;2,5-dimethyl-1,3-thiazole;1,3-dimethyl-1,2,4-triazole;3-fluoro-2,5-dimethylpyridine;methane;3,4,5-trimethyl-1,2-oxazole;2,3,5-trimethylpyridine;2,4,5-trimethyl-1,3-thiazole
CID 157150556
ethane;methylcyclohexane;2-methylfuran;5-methyl-1H-imidazole;4-methylmorpholine;4-methyl-1,2-oxazole;5-methyl-1,2-oxazole;4-methylpiperidine;2-methylpyridine;3-methylpyridine;2-methylpyrimidine;2-methyl-1H-pyrrole;2-methylthiophene;3-methylthiophene;toluene
CID 157171659
azetidine;cyclopentane;1,2-dihydropyridazine;ethane;furan;1H-imidazole;imidazolidine;docosakis(2-methylpropane);morpholine;oxane;1,2-oxazole;1,3-oxazolidine;oxolane;piperazine;piperidine;2H-pyran;1H-pyrazole;pyridine;1H-pyrrole;pyrrolidine;thiadiazole;1,3-thiazole;1,3-thiazolidine;thiophene
CID 157177030
1,3-ditert-butylbenzene;1,4-ditert-butylbenzene;2,3-ditert-butylfuran;3,4-ditert-butylfuran;1,4-ditert-butylpyrazole;1,5-ditert-butylpyrazole;3,5-ditert-butylpyridazine;2,4-ditert-butylpyridine;2,5-ditert-butylpyridine;2,5-ditert-butylpyrimidine;2,4-ditert-butyl-3H-pyrrole;3,5-ditert-butyl-2H-pyrrole;2,5-ditert-butyl-1,3-thiazole;2,4-ditert-butylthiophene;2,5-ditert-butylthiophene
CID 157182796
4-Tert-butyl-1,5-dimethyltriazole;5-tert-butyl-1,4-dimethyltriazole;2-tert-butylpyrimidine;cumene;ethane;furan;1-methylimidazole;hexadecakis(2-methylpropane);1-methylpyrazole;1-methylpyrrole;1-methyl-1,2,4-triazole;4-methyl-1,2,4-triazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,2-oxazole;1,3-oxazole;1-propan-2-yltetrazole;pyridine;1,2,4-thiadiazole;1,3,4-thiadiazole;1,2-thiazole;1,3-thiazole;thiophene
CID 157206232
1,2-Dimethylpyrrole;2-methylfuran;5-methyl-1,2-oxazole;5-methyl-1,3-oxazole;2-methylpyridine;3-methylpyridine;4-methylpyridine;4-methylpyrimidine;5-methylpyrimidine;5-methyl-1,2-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;2-methyl-1,3,5-triazine;toluene
CID 157222204
cis-(1S,3R)-1,3-dimethylcyclopentane;2,5-dimethylfuran;2,5-dimethyl-1H-imidazole;2,4-dimethyl-1,3-oxazole;1,4-dimethylpiperazine;bis(1,4-dimethylpiperidine);1,3-dimethylpyrazole;bis(2,5-dimethylpyridine);bis(2,5-dimethylpyrimidine);(3S)-1,3-dimethylpyrrolidine;2,5-dimethyl-1,3,4-thiadiazole;3,5-dimethyl-1,2,4-thiadiazole;bis(2,4-dimethyl-1,3-thiazole);bis(2,5-dimethyl-1,3-thiazole);bis(2,3-dimethylthiophene);bis(2,4-dimethylthiophene);2,5-dimethylthiophene;3,4-dimethylthiophene;1,4-dimethyltriazole;1,4-dimethyl-2H-triazol-1-ium;ethane;1-methylpyrazole
CID 157228387

Frequently Asked Questions

What is the IUPAC name of 2-methylcyclopenta-1,3-diene;2-methylfuran;2-methyl-4H-imidazole;5-methyl-4H-imidazole;3-methyl-1,2-oxazole;2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-3H-pyrrole;3-methyl-2H-pyrrole;4-methyl-2H-pyrrole;4-methyl-3H-pyrrole;5-methyl-2H-pyrrole;5-methyl-3H-pyrrole;3-methyl-1,2,4,5-tetrazine;2-methyl-1,3,4-thiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;5-methylthiatriazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;2-methyl-1,3,5-triazine;5-methyl-3H-1,2,4-triazole;5-methyl-4H-triazole?
The IUPAC name of 2-methylcyclopenta-1,3-diene;2-methylfuran;2-methyl-4H-imidazole;5-methyl-4H-imidazole;3-methyl-1,2-oxazole;2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-3H-pyrrole;3-methyl-2H-pyrrole;4-methyl-2H-pyrrole;4-methyl-3H-pyrrole;5-methyl-2H-pyrrole;5-methyl-3H-pyrrole;3-methyl-1,2,4,5-tetrazine;2-methyl-1,3,4-thiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;5-methylthiatriazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;2-methyl-1,3,5-triazine;5-methyl-3H-1,2,4-triazole;5-methyl-4H-triazole (CID 158756166) is 2-methylcyclopenta-1,3-diene;2-methylfuran;2-methyl-4H-imidazole;5-methyl-4H-imidazole;3-methyl-1,2-oxazole;2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-3H-pyrrole;3-methyl-2H-pyrrole;4-methyl-2H-pyrrole;4-methyl-3H-pyrrole;5-methyl-2H-pyrrole;5-methyl-3H-pyrrole;3-methyl-1,2,4,5-tetrazine;2-methyl-1,3,4-thiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;5-methylthiatriazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;2-methyl-1,3,5-triazine;5-methyl-3H-1,2,4-triazole;5-methyl-4H-triazole.
What is the SMILES notation for 2-methylcyclopenta-1,3-diene;2-methylfuran;2-methyl-4H-imidazole;5-methyl-4H-imidazole;3-methyl-1,2-oxazole;2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-3H-pyrrole;3-methyl-2H-pyrrole;4-methyl-2H-pyrrole;4-methyl-3H-pyrrole;5-methyl-2H-pyrrole;5-methyl-3H-pyrrole;3-methyl-1,2,4,5-tetrazine;2-methyl-1,3,4-thiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;5-methylthiatriazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;2-methyl-1,3,5-triazine;5-methyl-3H-1,2,4-triazole;5-methyl-4H-triazole?
The canonical SMILES for 2-methylcyclopenta-1,3-diene;2-methylfuran;2-methyl-4H-imidazole;5-methyl-4H-imidazole;3-methyl-1,2-oxazole;2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-3H-pyrrole;3-methyl-2H-pyrrole;4-methyl-2H-pyrrole;4-methyl-3H-pyrrole;5-methyl-2H-pyrrole;5-methyl-3H-pyrrole;3-methyl-1,2,4,5-tetrazine;2-methyl-1,3,4-thiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;5-methylthiatriazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;2-methyl-1,3,5-triazine;5-methyl-3H-1,2,4-triazole;5-methyl-4H-triazole is CC1=CC=NC1.CC1=CCC=C1.CC1=CCC=N1.CC1=CCN=C1.CC1=CN=CC1.CC1=NC=CC1.CC1=NC=NC1.CC1=NCC=C1.CC1=NCC=N1.CC1=NCN=N1.CC1=NN=NC1.Cc1ccccn1.Cc1cccnc1.Cc1cccnn1.Cc1ccco1.Cc1cccs1.Cc1ccncc1.Cc1ccncn1.Cc1ccnnc1.Cc1ccon1.Cc1ccsc1.Cc1cnccn1.Cc1cncnc1.Cc1cncs1.Cc1cnns1.Cc1cscn1.Cc1ncccn1.Cc1nccs1.Cc1ncncn1.Cc1ncns1.Cc1nncnn1.Cc1nncs1.Cc1nnns1.
What is the InChIKey of 2-methylcyclopenta-1,3-diene;2-methylfuran;2-methyl-4H-imidazole;5-methyl-4H-imidazole;3-methyl-1,2-oxazole;2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-3H-pyrrole;3-methyl-2H-pyrrole;4-methyl-2H-pyrrole;4-methyl-3H-pyrrole;5-methyl-2H-pyrrole;5-methyl-3H-pyrrole;3-methyl-1,2,4,5-tetrazine;2-methyl-1,3,4-thiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;5-methylthiatriazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;2-methyl-1,3,5-triazine;5-methyl-3H-1,2,4-triazole;5-methyl-4H-triazole?
The InChIKey is IOCJJIHBFNORCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/3C6H7N.C6H8.6C5H6N2.6C5H7N.C5H6O.2C5H6S.C4H5N3.2C4H6N2.C4H5NO.3C4H5NS.C3H4N4.2C3H5N3.3C3H4N2S.C2H3N3S/c1-6-2-4-7-5-3-6;1-6-3-2-4-7-5-6;1-6-4-2-3-5-7-6;1-6-4-2-3-5-6;1-5-2-6-4-7-3-5;1-5-4-6-2-3-7-5;1-5-2-3-6-4-7-5;1-5-2-3-6-7-4-5;1-5-6-3-2-4-7-5;1-5-3-2-4-6-7-5;3*1-5-2-3-6-4-5;4*1-5-3-2-4-6-5;1-5-2-3-6-4-5;1-5-3-2-4-6-5;1-4-6-2-5-3-7-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-4-2-3-6-5-4;1-4-2-6-3-5-4;1-4-2-5-3-6-4;1-4-5-2-3-6-4;1-3-6-4-2-5-7-3;1-3-4-2-5-6-3;1-3-2-4-6-5-3;1-3-5-4-2-6-3;1-3-4-2-5-6-3;1-3-2-4-5-6-3;1-2-3-4-5-6-2/h3*2-5H,1H3;2,4-5H,3H2,1H3;6*2-4H,1H3;3-4H,2H2,1H3;2,4H,3H2,1H3;2-3H,4H2,1H3;3-4H,2H2,1H3;2,4H,3H2,1H3;2-3H,4H2,1H3;3*2-4H,1H3;2-3H,1H3;3H,2H2,1H3;2H,3H2,1H3;4*2-3H,1H3;2H,1H3;2*2H2,1H3;3*2H,1H3;1H3.
What are the key properties of 2-methylcyclopenta-1,3-diene;2-methylfuran;2-methyl-4H-imidazole;5-methyl-4H-imidazole;3-methyl-1,2-oxazole;2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-3H-pyrrole;3-methyl-2H-pyrrole;4-methyl-2H-pyrrole;4-methyl-3H-pyrrole;5-methyl-2H-pyrrole;5-methyl-3H-pyrrole;3-methyl-1,2,4,5-tetrazine;2-methyl-1,3,4-thiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;5-methylthiatriazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;2-methyl-1,3,5-triazine;5-methyl-3H-1,2,4-triazole;5-methyl-4H-triazole?
2-methylcyclopenta-1,3-diene;2-methylfuran;2-methyl-4H-imidazole;5-methyl-4H-imidazole;3-methyl-1,2-oxazole;2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-3H-pyrrole;3-methyl-2H-pyrrole;4-methyl-2H-pyrrole;4-methyl-3H-pyrrole;5-methyl-2H-pyrrole;5-methyl-3H-pyrrole;3-methyl-1,2,4,5-tetrazine;2-methyl-1,3,4-thiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;5-methylthiatriazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;2-methyl-1,3,5-triazine;5-methyl-3H-1,2,4-triazole;5-methyl-4H-triazole has a molecular weight of 2993.10 g/mol, XLogP of 34.13, 0 rotatable bonds, 0 hydrogen bond donors, and 62 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylcyclopenta-1,3-diene;2-methylfuran;2-methyl-4H-imidazole;5-methyl-4H-imidazole;3-methyl-1,2-oxazole;2-methylpyrazine;3-methylpyridazine;4-methylpyridazine;2-methylpyridine;3-methylpyridine;4-methylpyridine;2-methylpyrimidine;4-methylpyrimidine;5-methylpyrimidine;2-methyl-3H-pyrrole;3-methyl-2H-pyrrole;4-methyl-2H-pyrrole;4-methyl-3H-pyrrole;5-methyl-2H-pyrrole;5-methyl-3H-pyrrole;3-methyl-1,2,4,5-tetrazine;2-methyl-1,3,4-thiadiazole;5-methylthiadiazole;5-methyl-1,2,4-thiadiazole;5-methylthiatriazole;2-methyl-1,3-thiazole;4-methyl-1,3-thiazole;5-methyl-1,3-thiazole;2-methylthiophene;3-methylthiophene;2-methyl-1,3,5-triazine;5-methyl-3H-1,2,4-triazole;5-methyl-4H-triazole is sourced from PubChem (CID 158756166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).