6-methyl-1H-benzimidazole;6-methyl-3H-1,3-benzothiazol-2-one;6-methyl-3H-1,3-benzoxazol-2-one;(6R)-6-methyl-1,3-diazinane-2,4-dione;5-methyl-1,3-dihydrobenzimidazol-2-one;3-methyl-4,5-dihydro-1H-pyridazin-6-one;5-methyl-1H-imidazole;5-methyl-1H-indazole;4-methylphenol;4-methylpiperidine-2,6-dione;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;3-methyl-1H-pyridazin-6-one;4-methyl-3H-pyridine-2,6-dione;6-methylpyridin-3-ol;4-methyl-1H-pyridin-2-one;5-methyl-1H-pyridin-2-one;5-methyl-1H-pyrimidine-2,4-dione;3-methyl-1H-pyrrole;bis(6-methyl-2H-1,2,4-triazine-3,5-dione);bis(5-methyl-1H-1,2,4-triazol-3-amine);4-methyl-2H-triazole

C131H163N45O22S — CID 159675289

IUPAC6-methyl-1H-benzimidazole;6-methyl-3H-1,3-benzothiazol-2-one;6-methyl-3H-1,3-benzoxazol-2-one;(6R)-6-methyl-1,3-diazinane-2,4-dione;5-methyl-1,3-dihydrobenzimidazol-2-one;3-methyl-4,5-dihydro-1H-pyridazin-6-one;5-methyl-1H-imidazole;5-methyl-1H-indazole;4-methylphenol;4-methylpiperidine-2,6-dione;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;3-methyl-1H-pyridazin-6-one;4-methyl-3H-pyridine-2,6-dione;6-methylpyridin-3-ol;4-methyl-1H-pyridin-2-one;5-methyl-1H-pyridin-2-one;5-methyl-1H-pyrimidine-2,4-dione;3-methyl-1H-pyrrole;bis(6-methyl-2H-1,2,4-triazine-3,5-dione);bis(5-methyl-1H-1,2,4-triazol-3-amine);4-methyl-2H-triazole
SMILESCC1=CC(=O)NC(=O)C1.CC1=NNC(=O)CC1.CC1CC(=O)NC(=O)C1.C[C@@H]1CC(=O)NC(=O)N1.Cc1c[nH]c(=O)[nH]c1=O.Cc1cc[nH]c(=O)c1.Cc1cc[nH]c1.Cc1ccc(=O)[nH]c1.Cc1ccc(=O)[nH]n1.Cc1ccc(O)cc1.Cc1ccc(O)cn1.Cc1ccc2[nH]c(=O)[nH]c2c1.Cc1ccc2[nH]c(=O)oc2c1.Cc1ccc2[nH]c(=O)sc2c1.Cc1ccc2[nH]ncc2c1.Cc1ccc2nc[nH]c2c1.Cc1ccn[nH]1.Cc1cn[nH]c1.Cc1cn[nH]n1.Cc1cnc[nH]1.Cc1n[nH]c(=O)[nH]c1=O.Cc1n[nH]c(=O)[nH]c1=O.Cc1nc(N)n[nH]1.Cc1nc(N)n[nH]1
InChIInChI=1S/C8H8N2O.2C8H8N2.C8H7NO2.C8H7NOS.C7H8O.C6H9NO2.C6H7NO2.3C6H7NO.C5H6N2O2.C5H8N2O2.C5H8N2O.C5H6N2O.C5H7N.2C4H5N3O2.3C4H6N2.2C3H6N4.C3H5N3/c1-5-2-3-6-7(4-5)10-8(11)9-6;1-6-2-3-8-7(4-6)5-9-10-8;1-6-2-3-7-8(4-6)10-5-9-7;2*1-5-2-3-6-7(4-5)11-8(10)9-6;1-6-2-4-7(8)5-3-6;2*1-4-2-5(8)7-6(9)3-4;1-5-2-3-6(8)4-7-5;1-5-2-3-7-6(8)4-5;1-5-2-3-6(8)7-4-5;1-3-2-6-5(9)7-4(3)8;1-3-2-4(8)7-5(9)6-3;2*1-4-2-3-5(8)7-6-4;1-5-2-3-6-4-5;2*1-2-3(8)5-4(9)7-6-2;1-4-2-5-3-6-4;1-4-2-5-6-3-4;1-4-2-3-5-6-4;2*1-2-5-3(4)7-6-2;1-3-2-4-6-5-3/h2-4H,1H3,(H2,9,10,11);2*2-5H,1H3,(H,9,10);2*2-4H,1H3,(H,9,10);2-5,8H,1H3;4H,2-3H2,1H3,(H,7,8,9);2H,3H2,1H3,(H,7,8,9);2-4,8H,1H3;2*2-4H,1H3,(H,7,8);2H,1H3,(H2,6,7,8,9);3H,2H2,1H3,(H2,6,7,8,9);2-3H2,1H3,(H,7,8);2-3H,1H3,(H,7,8);2-4,6H,1H3;2*1H3,(H2,5,7,8,9);3*2-3H,1H3,(H,5,6);2*1H3,(H3,4,5,6,7);2H,1H3,(H,4,5,6)/t;;;;;;;;;;;;3-;;;;;;;;;;;/m............1.........../s1
InChIKeyMUNFDWPJOFMCOA-AWELDMAHSA-N
MW2752.10 g/mol
LogP12.28
Rot. Bonds

About 6-methyl-1H-benzimidazole;6-methyl-3H-1,3-benzothiazol-2-one;6-methyl-3H-1,3-benzoxazol-2-one;(6R)-6-methyl-1,3-diazinane-2,4-dione;5-methyl-1,3-dihydrobenzimidazol-2-one;3-methyl-4,5-dihydro-1H-pyridazin-6-one;5-methyl-1H-imidazole;5-methyl-1H-indazole;4-methylphenol;4-methylpiperidine-2,6-dione;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;3-methyl-1H-pyridazin-6-one;4-methyl-3H-pyridine-2,6-dione;6-methylpyridin-3-ol;4-methyl-1H-pyridin-2-one;5-methyl-1H-pyridin-2-one;5-methyl-1H-pyrimidine-2,4-dione;3-methyl-1H-pyrrole;bis(6-methyl-2H-1,2,4-triazine-3,5-dione);bis(5-methyl-1H-1,2,4-triazol-3-amine);4-methyl-2H-triazole

6-methyl-1H-benzimidazole;6-methyl-3H-1,3-benzothiazol-2-one;6-methyl-3H-1,3-benzoxazol-2-one;(6R)-6-methyl-1,3-diazinane-2,4-dione;5-methyl-1,3-dihydrobenzimidazol-2-one;3-methyl-4,5-dihydro-1H-pyridazin-6-one;5-methyl-1H-imidazole;5-methyl-1H-indazole;4-methylphenol;4-methylpiperidine-2,6-dione;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;3-methyl-1H-pyridazin-6-one;4-methyl-3H-pyridine-2,6-dione;6-methylpyridin-3-ol;4-methyl-1H-pyridin-2-one;5-methyl-1H-pyridin-2-one;5-methyl-1H-pyrimidine-2,4-dione;3-methyl-1H-pyrrole;bis(6-methyl-2H-1,2,4-triazine-3,5-dione);bis(5-methyl-1H-1,2,4-triazol-3-amine);4-methyl-2H-triazole (PubChem CID 159675289) has the molecular formula C131H163N45O22S and a molecular weight of 2752.10 g/mol. Its IUPAC name is 6-methyl-1H-benzimidazole;6-methyl-3H-1,3-benzothiazol-2-one;6-methyl-3H-1,3-benzoxazol-2-one;(6R)-6-methyl-1,3-diazinane-2,4-dione;5-methyl-1,3-dihydrobenzimidazol-2-one;3-methyl-4,5-dihydro-1H-pyridazin-6-one;5-methyl-1H-imidazole;5-methyl-1H-indazole;4-methylphenol;4-methylpiperidine-2,6-dione;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;3-methyl-1H-pyridazin-6-one;4-methyl-3H-pyridine-2,6-dione;6-methylpyridin-3-ol;4-methyl-1H-pyridin-2-one;5-methyl-1H-pyridin-2-one;5-methyl-1H-pyrimidine-2,4-dione;3-methyl-1H-pyrrole;bis(6-methyl-2H-1,2,4-triazine-3,5-dione);bis(5-methyl-1H-1,2,4-triazol-3-amine);4-methyl-2H-triazole.

Molecular Properties

Compound Name6-methyl-1H-benzimidazole;6-methyl-3H-1,3-benzothiazol-2-one;6-methyl-3H-1,3-benzoxazol-2-one;(6R)-6-methyl-1,3-diazinane-2,4-dione;5-methyl-1,3-dihydrobenzimidazol-2-one;3-methyl-4,5-dihydro-1H-pyridazin-6-one;5-methyl-1H-imidazole;5-methyl-1H-indazole;4-methylphenol;4-methylpiperidine-2,6-dione;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;3-methyl-1H-pyridazin-6-one;4-methyl-3H-pyridine-2,6-dione;6-methylpyridin-3-ol;4-methyl-1H-pyridin-2-one;5-methyl-1H-pyridin-2-one;5-methyl-1H-pyrimidine-2,4-dione;3-methyl-1H-pyrrole;bis(6-methyl-2H-1,2,4-triazine-3,5-dione);bis(5-methyl-1H-1,2,4-triazol-3-amine);4-methyl-2H-triazole
PubChem CID159675289
Molecular FormulaC131H163N45O22S
Molecular Weight2752.10 g/mol
Exact Mass2750.27
IUPAC Name6-methyl-1H-benzimidazole;6-methyl-3H-1,3-benzothiazol-2-one;6-methyl-3H-1,3-benzoxazol-2-one;(6R)-6-methyl-1,3-diazinane-2,4-dione;5-methyl-1,3-dihydrobenzimidazol-2-one;3-methyl-4,5-dihydro-1H-pyridazin-6-one;5-methyl-1H-imidazole;5-methyl-1H-indazole;4-methylphenol;4-methylpiperidine-2,6-dione;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;3-methyl-1H-pyridazin-6-one;4-methyl-3H-pyridine-2,6-dione;6-methylpyridin-3-ol;4-methyl-1H-pyridin-2-one;5-methyl-1H-pyridin-2-one;5-methyl-1H-pyrimidine-2,4-dione;3-methyl-1H-pyrrole;bis(6-methyl-2H-1,2,4-triazine-3,5-dione);bis(5-methyl-1H-1,2,4-triazol-3-amine);4-methyl-2H-triazole
SMILESCC1=CC(=O)NC(=O)C1.CC1=NNC(=O)CC1.CC1CC(=O)NC(=O)C1.C[C@@H]1CC(=O)NC(=O)N1.Cc1c[nH]c(=O)[nH]c1=O.Cc1cc[nH]c(=O)c1.Cc1cc[nH]c1.Cc1ccc(=O)[nH]c1.Cc1ccc(=O)[nH]n1.Cc1ccc(O)cc1.Cc1ccc(O)cn1.Cc1ccc2[nH]c(=O)[nH]c2c1.Cc1ccc2[nH]c(=O)oc2c1.Cc1ccc2[nH]c(=O)sc2c1.Cc1ccc2[nH]ncc2c1.Cc1ccc2nc[nH]c2c1.Cc1ccn[nH]1.Cc1cn[nH]c1.Cc1cn[nH]n1.Cc1cnc[nH]1.Cc1n[nH]c(=O)[nH]c1=O.Cc1n[nH]c(=O)[nH]c1=O.Cc1nc(N)n[nH]1.Cc1nc(N)n[nH]1
InChIInChI=1S/C8H8N2O.2C8H8N2.C8H7NO2.C8H7NOS.C7H8O.C6H9NO2.C6H7NO2.3C6H7NO.C5H6N2O2.C5H8N2O2.C5H8N2O.C5H6N2O.C5H7N.2C4H5N3O2.3C4H6N2.2C3H6N4.C3H5N3/c1-5-2-3-6-7(4-5)10-8(11)9-6;1-6-2-3-8-7(4-6)5-9-10-8;1-6-2-3-7-8(4-6)10-5-9-7;2*1-5-2-3-6-7(4-5)11-8(10)9-6;1-6-2-4-7(8)5-3-6;2*1-4-2-5(8)7-6(9)3-4;1-5-2-3-6(8)4-7-5;1-5-2-3-7-6(8)4-5;1-5-2-3-6(8)7-4-5;1-3-2-6-5(9)7-4(3)8;1-3-2-4(8)7-5(9)6-3;2*1-4-2-3-5(8)7-6-4;1-5-2-3-6-4-5;2*1-2-3(8)5-4(9)7-6-2;1-4-2-5-3-6-4;1-4-2-5-6-3-4;1-4-2-3-5-6-4;2*1-2-5-3(4)7-6-2;1-3-2-4-6-5-3/h2-4H,1H3,(H2,9,10,11);2*2-5H,1H3,(H,9,10);2*2-4H,1H3,(H,9,10);2-5,8H,1H3;4H,2-3H2,1H3,(H,7,8,9);2H,3H2,1H3,(H,7,8,9);2-4,8H,1H3;2*2-4H,1H3,(H,7,8);2H,1H3,(H2,6,7,8,9);3H,2H2,1H3,(H2,6,7,8,9);2-3H2,1H3,(H,7,8);2-3H,1H3,(H,7,8);2-4,6H,1H3;2*1H3,(H2,5,7,8,9);3*2-3H,1H3,(H,5,6);2*1H3,(H3,4,5,6,7);2H,1H3,(H,4,5,6)/t;;;;;;;;;;;;3-;;;;;;;;;;;/m............1.........../s1
InChIKeyMUNFDWPJOFMCOA-AWELDMAHSA-N
XLogP12.28
TPSA1043.21 Ų
H-Bond Donors31
H-Bond Acceptors41
Rotatable Bonds
Heavy Atoms199
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002752.10
LogP ≤ 512.28
H-Bond Donors ≤ 531
H-Bond Acceptors ≤ 1041

Computed Properties (RDKit)

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

Analyze 6-methyl-1H-benzimidazole;6-methyl-3H-1,3-benzothiazol-2-one;6-methyl-3H-1,3-benzoxazol-2-one;(6R)-6-methyl-1,3-diazinane-2,4-dione;5-methyl-1,3-dihydrobenzimidazol-2-one;3-methyl-4,5-dihydro-1H-pyridazin-6-one;5-methyl-1H-imidazole;5-methyl-1H-indazole;4-methylphenol;4-methylpiperidine-2,6-dione;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;3-methyl-1H-pyridazin-6-one;4-methyl-3H-pyridine-2,6-dione;6-methylpyridin-3-ol;4-methyl-1H-pyridin-2-one;5-methyl-1H-pyridin-2-one;5-methyl-1H-pyrimidine-2,4-dione;3-methyl-1H-pyrrole;bis(6-methyl-2H-1,2,4-triazine-3,5-dione);bis(5-methyl-1H-1,2,4-triazol-3-amine);4-methyl-2H-triazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-1H-benzimidazole;6-methyl-3H-1,3-benzothiazol-2-one;6-methyl-3H-1,3-benzoxazol-2-one;(6R)-6-methyl-1,3-diazinane-2,4-dione;5-methyl-1,3-dihydrobenzimidazol-2-one;3-methyl-4,5-dihydro-1H-pyridazin-6-one;5-methyl-1H-imidazole;5-methyl-1H-indazole;4-methylphenol;4-methylpiperidine-2,6-dione;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;3-methyl-1H-pyridazin-6-one;4-methyl-3H-pyridine-2,6-dione;6-methylpyridin-3-ol;4-methyl-1H-pyridin-2-one;5-methyl-1H-pyridin-2-one;5-methyl-1H-pyrimidine-2,4-dione;3-methyl-1H-pyrrole;bis(6-methyl-2H-1,2,4-triazine-3,5-dione);bis(5-methyl-1H-1,2,4-triazol-3-amine);4-methyl-2H-triazole?
The IUPAC name of 6-methyl-1H-benzimidazole;6-methyl-3H-1,3-benzothiazol-2-one;6-methyl-3H-1,3-benzoxazol-2-one;(6R)-6-methyl-1,3-diazinane-2,4-dione;5-methyl-1,3-dihydrobenzimidazol-2-one;3-methyl-4,5-dihydro-1H-pyridazin-6-one;5-methyl-1H-imidazole;5-methyl-1H-indazole;4-methylphenol;4-methylpiperidine-2,6-dione;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;3-methyl-1H-pyridazin-6-one;4-methyl-3H-pyridine-2,6-dione;6-methylpyridin-3-ol;4-methyl-1H-pyridin-2-one;5-methyl-1H-pyridin-2-one;5-methyl-1H-pyrimidine-2,4-dione;3-methyl-1H-pyrrole;bis(6-methyl-2H-1,2,4-triazine-3,5-dione);bis(5-methyl-1H-1,2,4-triazol-3-amine);4-methyl-2H-triazole (CID 159675289) is 6-methyl-1H-benzimidazole;6-methyl-3H-1,3-benzothiazol-2-one;6-methyl-3H-1,3-benzoxazol-2-one;(6R)-6-methyl-1,3-diazinane-2,4-dione;5-methyl-1,3-dihydrobenzimidazol-2-one;3-methyl-4,5-dihydro-1H-pyridazin-6-one;5-methyl-1H-imidazole;5-methyl-1H-indazole;4-methylphenol;4-methylpiperidine-2,6-dione;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;3-methyl-1H-pyridazin-6-one;4-methyl-3H-pyridine-2,6-dione;6-methylpyridin-3-ol;4-methyl-1H-pyridin-2-one;5-methyl-1H-pyridin-2-one;5-methyl-1H-pyrimidine-2,4-dione;3-methyl-1H-pyrrole;bis(6-methyl-2H-1,2,4-triazine-3,5-dione);bis(5-methyl-1H-1,2,4-triazol-3-amine);4-methyl-2H-triazole.
What is the SMILES notation for 6-methyl-1H-benzimidazole;6-methyl-3H-1,3-benzothiazol-2-one;6-methyl-3H-1,3-benzoxazol-2-one;(6R)-6-methyl-1,3-diazinane-2,4-dione;5-methyl-1,3-dihydrobenzimidazol-2-one;3-methyl-4,5-dihydro-1H-pyridazin-6-one;5-methyl-1H-imidazole;5-methyl-1H-indazole;4-methylphenol;4-methylpiperidine-2,6-dione;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;3-methyl-1H-pyridazin-6-one;4-methyl-3H-pyridine-2,6-dione;6-methylpyridin-3-ol;4-methyl-1H-pyridin-2-one;5-methyl-1H-pyridin-2-one;5-methyl-1H-pyrimidine-2,4-dione;3-methyl-1H-pyrrole;bis(6-methyl-2H-1,2,4-triazine-3,5-dione);bis(5-methyl-1H-1,2,4-triazol-3-amine);4-methyl-2H-triazole?
The canonical SMILES for 6-methyl-1H-benzimidazole;6-methyl-3H-1,3-benzothiazol-2-one;6-methyl-3H-1,3-benzoxazol-2-one;(6R)-6-methyl-1,3-diazinane-2,4-dione;5-methyl-1,3-dihydrobenzimidazol-2-one;3-methyl-4,5-dihydro-1H-pyridazin-6-one;5-methyl-1H-imidazole;5-methyl-1H-indazole;4-methylphenol;4-methylpiperidine-2,6-dione;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;3-methyl-1H-pyridazin-6-one;4-methyl-3H-pyridine-2,6-dione;6-methylpyridin-3-ol;4-methyl-1H-pyridin-2-one;5-methyl-1H-pyridin-2-one;5-methyl-1H-pyrimidine-2,4-dione;3-methyl-1H-pyrrole;bis(6-methyl-2H-1,2,4-triazine-3,5-dione);bis(5-methyl-1H-1,2,4-triazol-3-amine);4-methyl-2H-triazole is CC1=CC(=O)NC(=O)C1.CC1=NNC(=O)CC1.CC1CC(=O)NC(=O)C1.C[C@@H]1CC(=O)NC(=O)N1.Cc1c[nH]c(=O)[nH]c1=O.Cc1cc[nH]c(=O)c1.Cc1cc[nH]c1.Cc1ccc(=O)[nH]c1.Cc1ccc(=O)[nH]n1.Cc1ccc(O)cc1.Cc1ccc(O)cn1.Cc1ccc2[nH]c(=O)[nH]c2c1.Cc1ccc2[nH]c(=O)oc2c1.Cc1ccc2[nH]c(=O)sc2c1.Cc1ccc2[nH]ncc2c1.Cc1ccc2nc[nH]c2c1.Cc1ccn[nH]1.Cc1cn[nH]c1.Cc1cn[nH]n1.Cc1cnc[nH]1.Cc1n[nH]c(=O)[nH]c1=O.Cc1n[nH]c(=O)[nH]c1=O.Cc1nc(N)n[nH]1.Cc1nc(N)n[nH]1.
What is the InChIKey of 6-methyl-1H-benzimidazole;6-methyl-3H-1,3-benzothiazol-2-one;6-methyl-3H-1,3-benzoxazol-2-one;(6R)-6-methyl-1,3-diazinane-2,4-dione;5-methyl-1,3-dihydrobenzimidazol-2-one;3-methyl-4,5-dihydro-1H-pyridazin-6-one;5-methyl-1H-imidazole;5-methyl-1H-indazole;4-methylphenol;4-methylpiperidine-2,6-dione;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;3-methyl-1H-pyridazin-6-one;4-methyl-3H-pyridine-2,6-dione;6-methylpyridin-3-ol;4-methyl-1H-pyridin-2-one;5-methyl-1H-pyridin-2-one;5-methyl-1H-pyrimidine-2,4-dione;3-methyl-1H-pyrrole;bis(6-methyl-2H-1,2,4-triazine-3,5-dione);bis(5-methyl-1H-1,2,4-triazol-3-amine);4-methyl-2H-triazole?
The InChIKey is MUNFDWPJOFMCOA-AWELDMAHSA-N. The full InChI is InChI=1S/C8H8N2O.2C8H8N2.C8H7NO2.C8H7NOS.C7H8O.C6H9NO2.C6H7NO2.3C6H7NO.C5H6N2O2.C5H8N2O2.C5H8N2O.C5H6N2O.C5H7N.2C4H5N3O2.3C4H6N2.2C3H6N4.C3H5N3/c1-5-2-3-6-7(4-5)10-8(11)9-6;1-6-2-3-8-7(4-6)5-9-10-8;1-6-2-3-7-8(4-6)10-5-9-7;2*1-5-2-3-6-7(4-5)11-8(10)9-6;1-6-2-4-7(8)5-3-6;2*1-4-2-5(8)7-6(9)3-4;1-5-2-3-6(8)4-7-5;1-5-2-3-7-6(8)4-5;1-5-2-3-6(8)7-4-5;1-3-2-6-5(9)7-4(3)8;1-3-2-4(8)7-5(9)6-3;2*1-4-2-3-5(8)7-6-4;1-5-2-3-6-4-5;2*1-2-3(8)5-4(9)7-6-2;1-4-2-5-3-6-4;1-4-2-5-6-3-4;1-4-2-3-5-6-4;2*1-2-5-3(4)7-6-2;1-3-2-4-6-5-3/h2-4H,1H3,(H2,9,10,11);2*2-5H,1H3,(H,9,10);2*2-4H,1H3,(H,9,10);2-5,8H,1H3;4H,2-3H2,1H3,(H,7,8,9);2H,3H2,1H3,(H,7,8,9);2-4,8H,1H3;2*2-4H,1H3,(H,7,8);2H,1H3,(H2,6,7,8,9);3H,2H2,1H3,(H2,6,7,8,9);2-3H2,1H3,(H,7,8);2-3H,1H3,(H,7,8);2-4,6H,1H3;2*1H3,(H2,5,7,8,9);3*2-3H,1H3,(H,5,6);2*1H3,(H3,4,5,6,7);2H,1H3,(H,4,5,6)/t;;;;;;;;;;;;3-;;;;;;;;;;;/m............1.........../s1.
What are the key properties of 6-methyl-1H-benzimidazole;6-methyl-3H-1,3-benzothiazol-2-one;6-methyl-3H-1,3-benzoxazol-2-one;(6R)-6-methyl-1,3-diazinane-2,4-dione;5-methyl-1,3-dihydrobenzimidazol-2-one;3-methyl-4,5-dihydro-1H-pyridazin-6-one;5-methyl-1H-imidazole;5-methyl-1H-indazole;4-methylphenol;4-methylpiperidine-2,6-dione;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;3-methyl-1H-pyridazin-6-one;4-methyl-3H-pyridine-2,6-dione;6-methylpyridin-3-ol;4-methyl-1H-pyridin-2-one;5-methyl-1H-pyridin-2-one;5-methyl-1H-pyrimidine-2,4-dione;3-methyl-1H-pyrrole;bis(6-methyl-2H-1,2,4-triazine-3,5-dione);bis(5-methyl-1H-1,2,4-triazol-3-amine);4-methyl-2H-triazole?
6-methyl-1H-benzimidazole;6-methyl-3H-1,3-benzothiazol-2-one;6-methyl-3H-1,3-benzoxazol-2-one;(6R)-6-methyl-1,3-diazinane-2,4-dione;5-methyl-1,3-dihydrobenzimidazol-2-one;3-methyl-4,5-dihydro-1H-pyridazin-6-one;5-methyl-1H-imidazole;5-methyl-1H-indazole;4-methylphenol;4-methylpiperidine-2,6-dione;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;3-methyl-1H-pyridazin-6-one;4-methyl-3H-pyridine-2,6-dione;6-methylpyridin-3-ol;4-methyl-1H-pyridin-2-one;5-methyl-1H-pyridin-2-one;5-methyl-1H-pyrimidine-2,4-dione;3-methyl-1H-pyrrole;bis(6-methyl-2H-1,2,4-triazine-3,5-dione);bis(5-methyl-1H-1,2,4-triazol-3-amine);4-methyl-2H-triazole has a molecular weight of 2752.10 g/mol, XLogP of 12.28, 0 rotatable bonds, 31 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-1H-benzimidazole;6-methyl-3H-1,3-benzothiazol-2-one;6-methyl-3H-1,3-benzoxazol-2-one;(6R)-6-methyl-1,3-diazinane-2,4-dione;5-methyl-1,3-dihydrobenzimidazol-2-one;3-methyl-4,5-dihydro-1H-pyridazin-6-one;5-methyl-1H-imidazole;5-methyl-1H-indazole;4-methylphenol;4-methylpiperidine-2,6-dione;4-methyl-1H-pyrazole;5-methyl-1H-pyrazole;3-methyl-1H-pyridazin-6-one;4-methyl-3H-pyridine-2,6-dione;6-methylpyridin-3-ol;4-methyl-1H-pyridin-2-one;5-methyl-1H-pyridin-2-one;5-methyl-1H-pyrimidine-2,4-dione;3-methyl-1H-pyrrole;bis(6-methyl-2H-1,2,4-triazine-3,5-dione);bis(5-methyl-1H-1,2,4-triazol-3-amine);4-methyl-2H-triazole is sourced from PubChem (CID 159675289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).