1-benzyl-5-methylimidazole;6-chloro-2-methylimidazo[1,2-a]pyridine;2-(4-chlorophenyl)-5-methylfuran;2,3-dimethylfuran;3,5-dimethyl-1,2-oxazole;1,4-dimethylpiperidine;2,5-dimethylpyrazine;6-methoxy-2-methyl-2,3-dihydrofuro[2,3-b]pyridine;2-methyl-1-benzofuran;1-methylbenzotriazole;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;6-methyl-2,3-dihydro-1-benzofuran;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;4-methylmorpholine;5-methyl-1,2-oxazole;3-methyloxolane;2-methylquinoxaline;5-methyl-1,2,4-thiadiazole

C151H178Cl2N24O15S — CID 158226009

IUPAC1-benzyl-5-methylimidazole;6-chloro-2-methylimidazo[1,2-a]pyridine;2-(4-chlorophenyl)-5-methylfuran;2,3-dimethylfuran;3,5-dimethyl-1,2-oxazole;1,4-dimethylpiperidine;2,5-dimethylpyrazine;6-methoxy-2-methyl-2,3-dihydrofuro[2,3-b]pyridine;2-methyl-1-benzofuran;1-methylbenzotriazole;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;6-methyl-2,3-dihydro-1-benzofuran;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;4-methylmorpholine;5-methyl-1,2-oxazole;3-methyloxolane;2-methylquinoxaline;5-methyl-1,2,4-thiadiazole
SMILESCC1CCN(C)CC1.CC1CCOC1.CN1CCOCC1.COc1ccc2c(n1)OC(C)C2.Cc1cc(C)on1.Cc1cc2ccccc2o1.Cc1ccc(-c2ccc(Cl)cc2)o1.Cc1ccc2c(c1)OCC2.Cc1ccc2nonc2c1.Cc1ccco1.Cc1ccno1.Cc1ccoc1.Cc1ccoc1C.Cc1cn2cc(Cl)ccc2n1.Cc1cnc(C)cn1.Cc1cnc2ccccc2n1.Cc1cncn1Cc1ccccc1.Cc1nc2ccccc2o1.Cc1ncc[nH]1.Cc1ncns1.Cc1noc2ccccc12.Cn1nnc2ccccc21
InChIInChI=1S/C11H9ClO.C11H12N2.C9H8N2.C9H11NO2.C9H10O.C9H8O.C8H7ClN2.2C8H7NO.C7H7N3.C7H6N2O.C7H15N.C6H8N2.C6H8O.C5H11NO.C5H7NO.C5H10O.2C5H6O.C4H6N2.C4H5NO.C3H4N2S/c1-8-2-7-11(13-8)9-3-5-10(12)6-4-9;1-10-7-12-9-13(10)8-11-5-3-2-4-6-11;1-7-6-10-8-4-2-3-5-9(8)11-7;1-6-5-7-3-4-8(11-2)10-9(7)12-6;1-7-2-3-8-4-5-10-9(8)6-7;1-7-6-8-4-2-3-5-9(8)10-7;1-6-4-11-5-7(9)2-3-8(11)10-6;1-6-9-7-4-2-3-5-8(7)10-6;1-6-7-4-2-3-5-8(7)10-9-6;1-10-7-5-3-2-4-6(7)8-9-10;1-5-2-3-6-7(4-5)9-10-8-6;1-7-3-5-8(2)6-4-7;1-5-3-8-6(2)4-7-5;1-5-3-4-7-6(5)2;1-6-2-4-7-5-3-6;1-4-3-5(2)7-6-4;2*1-5-2-3-6-4-5;1-5-3-2-4-6-5;1-4-5-2-3-6-4;1-4-2-3-5-6-4;1-3-4-2-5-6-3/h2-7H,1H3;2-7,9H,8H2,1H3;2-6H,1H3;3-4,6H,5H2,1-2H3;2-3,6H,4-5H2,1H3;2-6H,1H3;2-5H,1H3;3*2-5H,1H3;2-4H,1H3;7H,3-6H2,1-2H3;3-4H,1-2H3;3-4H,1-2H3;2-5H2,1H3;3H,1-2H3;5H,2-4H2,1H3;2*2-4H,1H3;2-3H,1H3,(H,5,6);2-3H,1H3;2H,1H3
InChIKeyGDUPRIZUUKKHSB-UHFFFAOYSA-N
MW2672.21 g/mol
LogP35.58
Rot. Bonds4

About 1-benzyl-5-methylimidazole;6-chloro-2-methylimidazo[1,2-a]pyridine;2-(4-chlorophenyl)-5-methylfuran;2,3-dimethylfuran;3,5-dimethyl-1,2-oxazole;1,4-dimethylpiperidine;2,5-dimethylpyrazine;6-methoxy-2-methyl-2,3-dihydrofuro[2,3-b]pyridine;2-methyl-1-benzofuran;1-methylbenzotriazole;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;6-methyl-2,3-dihydro-1-benzofuran;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;4-methylmorpholine;5-methyl-1,2-oxazole;3-methyloxolane;2-methylquinoxaline;5-methyl-1,2,4-thiadiazole

1-benzyl-5-methylimidazole;6-chloro-2-methylimidazo[1,2-a]pyridine;2-(4-chlorophenyl)-5-methylfuran;2,3-dimethylfuran;3,5-dimethyl-1,2-oxazole;1,4-dimethylpiperidine;2,5-dimethylpyrazine;6-methoxy-2-methyl-2,3-dihydrofuro[2,3-b]pyridine;2-methyl-1-benzofuran;1-methylbenzotriazole;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;6-methyl-2,3-dihydro-1-benzofuran;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;4-methylmorpholine;5-methyl-1,2-oxazole;3-methyloxolane;2-methylquinoxaline;5-methyl-1,2,4-thiadiazole (PubChem CID 158226009) has the molecular formula C151H178Cl2N24O15S and a molecular weight of 2672.21 g/mol. Its IUPAC name is 1-benzyl-5-methylimidazole;6-chloro-2-methylimidazo[1,2-a]pyridine;2-(4-chlorophenyl)-5-methylfuran;2,3-dimethylfuran;3,5-dimethyl-1,2-oxazole;1,4-dimethylpiperidine;2,5-dimethylpyrazine;6-methoxy-2-methyl-2,3-dihydrofuro[2,3-b]pyridine;2-methyl-1-benzofuran;1-methylbenzotriazole;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;6-methyl-2,3-dihydro-1-benzofuran;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;4-methylmorpholine;5-methyl-1,2-oxazole;3-methyloxolane;2-methylquinoxaline;5-methyl-1,2,4-thiadiazole.

Molecular Properties

Compound Name1-benzyl-5-methylimidazole;6-chloro-2-methylimidazo[1,2-a]pyridine;2-(4-chlorophenyl)-5-methylfuran;2,3-dimethylfuran;3,5-dimethyl-1,2-oxazole;1,4-dimethylpiperidine;2,5-dimethylpyrazine;6-methoxy-2-methyl-2,3-dihydrofuro[2,3-b]pyridine;2-methyl-1-benzofuran;1-methylbenzotriazole;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;6-methyl-2,3-dihydro-1-benzofuran;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;4-methylmorpholine;5-methyl-1,2-oxazole;3-methyloxolane;2-methylquinoxaline;5-methyl-1,2,4-thiadiazole
PubChem CID158226009
Molecular FormulaC151H178Cl2N24O15S
Molecular Weight2672.21 g/mol
Exact Mass2669.30
IUPAC Name1-benzyl-5-methylimidazole;6-chloro-2-methylimidazo[1,2-a]pyridine;2-(4-chlorophenyl)-5-methylfuran;2,3-dimethylfuran;3,5-dimethyl-1,2-oxazole;1,4-dimethylpiperidine;2,5-dimethylpyrazine;6-methoxy-2-methyl-2,3-dihydrofuro[2,3-b]pyridine;2-methyl-1-benzofuran;1-methylbenzotriazole;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;6-methyl-2,3-dihydro-1-benzofuran;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;4-methylmorpholine;5-methyl-1,2-oxazole;3-methyloxolane;2-methylquinoxaline;5-methyl-1,2,4-thiadiazole
SMILESCC1CCN(C)CC1.CC1CCOC1.CN1CCOCC1.COc1ccc2c(n1)OC(C)C2.Cc1cc(C)on1.Cc1cc2ccccc2o1.Cc1ccc(-c2ccc(Cl)cc2)o1.Cc1ccc2c(c1)OCC2.Cc1ccc2nonc2c1.Cc1ccco1.Cc1ccno1.Cc1ccoc1.Cc1ccoc1C.Cc1cn2cc(Cl)ccc2n1.Cc1cnc(C)cn1.Cc1cnc2ccccc2n1.Cc1cncn1Cc1ccccc1.Cc1nc2ccccc2o1.Cc1ncc[nH]1.Cc1ncns1.Cc1noc2ccccc12.Cn1nnc2ccccc21
InChIInChI=1S/C11H9ClO.C11H12N2.C9H8N2.C9H11NO2.C9H10O.C9H8O.C8H7ClN2.2C8H7NO.C7H7N3.C7H6N2O.C7H15N.C6H8N2.C6H8O.C5H11NO.C5H7NO.C5H10O.2C5H6O.C4H6N2.C4H5NO.C3H4N2S/c1-8-2-7-11(13-8)9-3-5-10(12)6-4-9;1-10-7-12-9-13(10)8-11-5-3-2-4-6-11;1-7-6-10-8-4-2-3-5-9(8)11-7;1-6-5-7-3-4-8(11-2)10-9(7)12-6;1-7-2-3-8-4-5-10-9(8)6-7;1-7-6-8-4-2-3-5-9(8)10-7;1-6-4-11-5-7(9)2-3-8(11)10-6;1-6-9-7-4-2-3-5-8(7)10-6;1-6-7-4-2-3-5-8(7)10-9-6;1-10-7-5-3-2-4-6(7)8-9-10;1-5-2-3-6-7(4-5)9-10-8-6;1-7-3-5-8(2)6-4-7;1-5-3-8-6(2)4-7-5;1-5-3-4-7-6(5)2;1-6-2-4-7-5-3-6;1-4-3-5(2)7-6-4;2*1-5-2-3-6-4-5;1-5-3-2-4-6-5;1-4-5-2-3-6-4;1-4-2-3-5-6-4;1-3-4-2-5-6-3/h2-7H,1H3;2-7,9H,8H2,1H3;2-6H,1H3;3-4,6H,5H2,1-2H3;2-3,6H,4-5H2,1H3;2-6H,1H3;2-5H,1H3;3*2-5H,1H3;2-4H,1H3;7H,3-6H2,1-2H3;3-4H,1-2H3;3-4H,1-2H3;2-5H2,1H3;3H,1-2H3;5H,2-4H2,1H3;2*2-4H,1H3;2-3H,1H3,(H,5,6);2-3H,1H3;2H,1H3
InChIKeyGDUPRIZUUKKHSB-UHFFFAOYSA-N
XLogP35.58
TPSA446.11 Ų
H-Bond Donors1
H-Bond Acceptors39
Rotatable Bonds4
Heavy Atoms193
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002672.21
LogP ≤ 535.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1039

Analyze 1-benzyl-5-methylimidazole;6-chloro-2-methylimidazo[1,2-a]pyridine;2-(4-chlorophenyl)-5-methylfuran;2,3-dimethylfuran;3,5-dimethyl-1,2-oxazole;1,4-dimethylpiperidine;2,5-dimethylpyrazine;6-methoxy-2-methyl-2,3-dihydrofuro[2,3-b]pyridine;2-methyl-1-benzofuran;1-methylbenzotriazole;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;6-methyl-2,3-dihydro-1-benzofuran;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;4-methylmorpholine;5-methyl-1,2-oxazole;3-methyloxolane;2-methylquinoxaline;5-methyl-1,2,4-thiadiazole with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-5-methylimidazole;6-chloro-2-methylimidazo[1,2-a]pyridine;2-(4-chlorophenyl)-5-methylfuran;2,3-dimethylfuran;3,5-dimethyl-1,2-oxazole;1,4-dimethylpiperidine;2,5-dimethylpyrazine;6-methoxy-2-methyl-2,3-dihydrofuro[2,3-b]pyridine;2-methyl-1-benzofuran;1-methylbenzotriazole;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;6-methyl-2,3-dihydro-1-benzofuran;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;4-methylmorpholine;5-methyl-1,2-oxazole;3-methyloxolane;2-methylquinoxaline;5-methyl-1,2,4-thiadiazole?
The IUPAC name of 1-benzyl-5-methylimidazole;6-chloro-2-methylimidazo[1,2-a]pyridine;2-(4-chlorophenyl)-5-methylfuran;2,3-dimethylfuran;3,5-dimethyl-1,2-oxazole;1,4-dimethylpiperidine;2,5-dimethylpyrazine;6-methoxy-2-methyl-2,3-dihydrofuro[2,3-b]pyridine;2-methyl-1-benzofuran;1-methylbenzotriazole;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;6-methyl-2,3-dihydro-1-benzofuran;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;4-methylmorpholine;5-methyl-1,2-oxazole;3-methyloxolane;2-methylquinoxaline;5-methyl-1,2,4-thiadiazole (CID 158226009) is 1-benzyl-5-methylimidazole;6-chloro-2-methylimidazo[1,2-a]pyridine;2-(4-chlorophenyl)-5-methylfuran;2,3-dimethylfuran;3,5-dimethyl-1,2-oxazole;1,4-dimethylpiperidine;2,5-dimethylpyrazine;6-methoxy-2-methyl-2,3-dihydrofuro[2,3-b]pyridine;2-methyl-1-benzofuran;1-methylbenzotriazole;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;6-methyl-2,3-dihydro-1-benzofuran;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;4-methylmorpholine;5-methyl-1,2-oxazole;3-methyloxolane;2-methylquinoxaline;5-methyl-1,2,4-thiadiazole.
What is the SMILES notation for 1-benzyl-5-methylimidazole;6-chloro-2-methylimidazo[1,2-a]pyridine;2-(4-chlorophenyl)-5-methylfuran;2,3-dimethylfuran;3,5-dimethyl-1,2-oxazole;1,4-dimethylpiperidine;2,5-dimethylpyrazine;6-methoxy-2-methyl-2,3-dihydrofuro[2,3-b]pyridine;2-methyl-1-benzofuran;1-methylbenzotriazole;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;6-methyl-2,3-dihydro-1-benzofuran;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;4-methylmorpholine;5-methyl-1,2-oxazole;3-methyloxolane;2-methylquinoxaline;5-methyl-1,2,4-thiadiazole?
The canonical SMILES for 1-benzyl-5-methylimidazole;6-chloro-2-methylimidazo[1,2-a]pyridine;2-(4-chlorophenyl)-5-methylfuran;2,3-dimethylfuran;3,5-dimethyl-1,2-oxazole;1,4-dimethylpiperidine;2,5-dimethylpyrazine;6-methoxy-2-methyl-2,3-dihydrofuro[2,3-b]pyridine;2-methyl-1-benzofuran;1-methylbenzotriazole;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;6-methyl-2,3-dihydro-1-benzofuran;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;4-methylmorpholine;5-methyl-1,2-oxazole;3-methyloxolane;2-methylquinoxaline;5-methyl-1,2,4-thiadiazole is CC1CCN(C)CC1.CC1CCOC1.CN1CCOCC1.COc1ccc2c(n1)OC(C)C2.Cc1cc(C)on1.Cc1cc2ccccc2o1.Cc1ccc(-c2ccc(Cl)cc2)o1.Cc1ccc2c(c1)OCC2.Cc1ccc2nonc2c1.Cc1ccco1.Cc1ccno1.Cc1ccoc1.Cc1ccoc1C.Cc1cn2cc(Cl)ccc2n1.Cc1cnc(C)cn1.Cc1cnc2ccccc2n1.Cc1cncn1Cc1ccccc1.Cc1nc2ccccc2o1.Cc1ncc[nH]1.Cc1ncns1.Cc1noc2ccccc12.Cn1nnc2ccccc21.
What is the InChIKey of 1-benzyl-5-methylimidazole;6-chloro-2-methylimidazo[1,2-a]pyridine;2-(4-chlorophenyl)-5-methylfuran;2,3-dimethylfuran;3,5-dimethyl-1,2-oxazole;1,4-dimethylpiperidine;2,5-dimethylpyrazine;6-methoxy-2-methyl-2,3-dihydrofuro[2,3-b]pyridine;2-methyl-1-benzofuran;1-methylbenzotriazole;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;6-methyl-2,3-dihydro-1-benzofuran;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;4-methylmorpholine;5-methyl-1,2-oxazole;3-methyloxolane;2-methylquinoxaline;5-methyl-1,2,4-thiadiazole?
The InChIKey is GDUPRIZUUKKHSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClO.C11H12N2.C9H8N2.C9H11NO2.C9H10O.C9H8O.C8H7ClN2.2C8H7NO.C7H7N3.C7H6N2O.C7H15N.C6H8N2.C6H8O.C5H11NO.C5H7NO.C5H10O.2C5H6O.C4H6N2.C4H5NO.C3H4N2S/c1-8-2-7-11(13-8)9-3-5-10(12)6-4-9;1-10-7-12-9-13(10)8-11-5-3-2-4-6-11;1-7-6-10-8-4-2-3-5-9(8)11-7;1-6-5-7-3-4-8(11-2)10-9(7)12-6;1-7-2-3-8-4-5-10-9(8)6-7;1-7-6-8-4-2-3-5-9(8)10-7;1-6-4-11-5-7(9)2-3-8(11)10-6;1-6-9-7-4-2-3-5-8(7)10-6;1-6-7-4-2-3-5-8(7)10-9-6;1-10-7-5-3-2-4-6(7)8-9-10;1-5-2-3-6-7(4-5)9-10-8-6;1-7-3-5-8(2)6-4-7;1-5-3-8-6(2)4-7-5;1-5-3-4-7-6(5)2;1-6-2-4-7-5-3-6;1-4-3-5(2)7-6-4;2*1-5-2-3-6-4-5;1-5-3-2-4-6-5;1-4-5-2-3-6-4;1-4-2-3-5-6-4;1-3-4-2-5-6-3/h2-7H,1H3;2-7,9H,8H2,1H3;2-6H,1H3;3-4,6H,5H2,1-2H3;2-3,6H,4-5H2,1H3;2-6H,1H3;2-5H,1H3;3*2-5H,1H3;2-4H,1H3;7H,3-6H2,1-2H3;3-4H,1-2H3;3-4H,1-2H3;2-5H2,1H3;3H,1-2H3;5H,2-4H2,1H3;2*2-4H,1H3;2-3H,1H3,(H,5,6);2-3H,1H3;2H,1H3.
What are the key properties of 1-benzyl-5-methylimidazole;6-chloro-2-methylimidazo[1,2-a]pyridine;2-(4-chlorophenyl)-5-methylfuran;2,3-dimethylfuran;3,5-dimethyl-1,2-oxazole;1,4-dimethylpiperidine;2,5-dimethylpyrazine;6-methoxy-2-methyl-2,3-dihydrofuro[2,3-b]pyridine;2-methyl-1-benzofuran;1-methylbenzotriazole;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;6-methyl-2,3-dihydro-1-benzofuran;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;4-methylmorpholine;5-methyl-1,2-oxazole;3-methyloxolane;2-methylquinoxaline;5-methyl-1,2,4-thiadiazole?
1-benzyl-5-methylimidazole;6-chloro-2-methylimidazo[1,2-a]pyridine;2-(4-chlorophenyl)-5-methylfuran;2,3-dimethylfuran;3,5-dimethyl-1,2-oxazole;1,4-dimethylpiperidine;2,5-dimethylpyrazine;6-methoxy-2-methyl-2,3-dihydrofuro[2,3-b]pyridine;2-methyl-1-benzofuran;1-methylbenzotriazole;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;6-methyl-2,3-dihydro-1-benzofuran;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;4-methylmorpholine;5-methyl-1,2-oxazole;3-methyloxolane;2-methylquinoxaline;5-methyl-1,2,4-thiadiazole has a molecular weight of 2672.21 g/mol, XLogP of 35.58, 4 rotatable bonds, 1 hydrogen bond donors, and 39 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-5-methylimidazole;6-chloro-2-methylimidazo[1,2-a]pyridine;2-(4-chlorophenyl)-5-methylfuran;2,3-dimethylfuran;3,5-dimethyl-1,2-oxazole;1,4-dimethylpiperidine;2,5-dimethylpyrazine;6-methoxy-2-methyl-2,3-dihydrofuro[2,3-b]pyridine;2-methyl-1-benzofuran;1-methylbenzotriazole;5-methyl-2,1,3-benzoxadiazole;2-methyl-1,3-benzoxazole;3-methyl-1,2-benzoxazole;6-methyl-2,3-dihydro-1-benzofuran;2-methylfuran;3-methylfuran;2-methyl-1H-imidazole;4-methylmorpholine;5-methyl-1,2-oxazole;3-methyloxolane;2-methylquinoxaline;5-methyl-1,2,4-thiadiazole is sourced from PubChem (CID 158226009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).