cumene;methane;4-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1,3-benzothiazole;bis(propan-2-ylcyclohexane);bis(propan-2-ylcyclopentane);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-yl-2H-pyrrole;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,2,4-thiadiazole;bis(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;5-propan-2-yl-1H-1,2,4-triazole

C248H428N32O6S7 — CID 158805826

IUPACcumene;methane;4-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1,3-benzothiazole;bis(propan-2-ylcyclohexane);bis(propan-2-ylcyclopentane);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-yl-2H-pyrrole;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,2,4-thiadiazole;bis(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;5-propan-2-yl-1H-1,2,4-triazole
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)C1=NCC=C1.CC(C)C1=NCC=N1.CC(C)C1CCCC1.CC(C)C1CCCC1.CC(C)C1CCCCC1.CC(C)C1CCCCC1.CC(C)N1CCCC1.CC(C)c1cccc2c1OCO2.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1ccccn1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1cccnc1.CC(C)c1ccco1.CC(C)c1cccs1.CC(C)c1ccn[nH]1.CC(C)c1ccno1.CC(C)c1cnc[nH]1.CC(C)c1cnccn1.CC(C)c1cncs1.CC(C)c1cscn1.CC(C)c1nc2ccccc2s1.CC(C)c1ncc[nH]1.CC(C)c1ncccn1.CC(C)c1ncco1.CC(C)c1ncco1.CC(C)c1nccs1.CC(C)c1nccs1.CC(C)c1ncn[nH]1.CC(C)c1ncns1
InChIInChI=1S/C10H11NS.C10H12O2.2C9H18.2C9H12.5C8H11N.2C8H16.2C7H10N2.C7H15N.C7H11N.C7H10O.C7H10S.4C6H10N2.3C6H9NO.4C6H9NS.C5H9N3.C5H8N2S.18CH4/c1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-7(2)8-4-3-5-9-10(8)12-6-11-9;4*1-8(2)9-6-4-3-5-7-9;2*1-7(2)8-4-3-5-9-6-8;3*1-7(2)8-5-3-4-6-9-8;2*1-7(2)8-5-3-4-6-8;1-6(2)7-5-8-3-4-9-7;1-6(2)7-8-4-3-5-9-7;1-7(2)8-5-3-4-6-8;3*1-6(2)7-4-3-5-8-7;1-5(2)6-3-7-4-8-6;2*1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-7-8-6;2*1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-7-8-6;1-5(2)6-3-8-4-7-6;1-5(2)6-3-7-4-8-6;2*1-5(2)6-7-3-4-8-6;2*1-4(2)5-6-3-7-8-5;;;;;;;;;;;;;;;;;;/h3-7H,1-2H3;3-5,7H,6H2,1-2H3;2*8-9H,3-7H2,1-2H3;2*3-8H,1-2H3;5*3-7H,1-2H3;2*7-8H,3-6H2,1-2H3;2*3-6H,1-2H3;7H,3-6H2,1-2H3;3-4,6H,5H2,1-2H3;2*3-6H,1-2H3;3-5H,1-2H3,(H,7,8);3,5H,4H2,1-2H3;2*3-5H,1-2H3,(H,7,8);7*3-5H,1-2H3;3-4H,1-2H3,(H,6,7,8);3-4H,1-2H3;18*1H4
InChIKeyIUBIIGKFGQHTKR-UHFFFAOYSA-N
MW4178.84 g/mol
LogP80.56
Rot. Bonds32

About cumene;methane;4-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1,3-benzothiazole;bis(propan-2-ylcyclohexane);bis(propan-2-ylcyclopentane);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-yl-2H-pyrrole;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,2,4-thiadiazole;bis(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;5-propan-2-yl-1H-1,2,4-triazole

cumene;methane;4-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1,3-benzothiazole;bis(propan-2-ylcyclohexane);bis(propan-2-ylcyclopentane);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-yl-2H-pyrrole;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,2,4-thiadiazole;bis(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;5-propan-2-yl-1H-1,2,4-triazole (PubChem CID 158805826) has the molecular formula C248H428N32O6S7 and a molecular weight of 4178.84 g/mol. Its IUPAC name is cumene;methane;4-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1,3-benzothiazole;bis(propan-2-ylcyclohexane);bis(propan-2-ylcyclopentane);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-yl-2H-pyrrole;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,2,4-thiadiazole;bis(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;5-propan-2-yl-1H-1,2,4-triazole.

Molecular Properties

Compound Namecumene;methane;4-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1,3-benzothiazole;bis(propan-2-ylcyclohexane);bis(propan-2-ylcyclopentane);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-yl-2H-pyrrole;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,2,4-thiadiazole;bis(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;5-propan-2-yl-1H-1,2,4-triazole
PubChem CID158805826
Molecular FormulaC248H428N32O6S7
Molecular Weight4178.84 g/mol
Exact Mass4175.22
IUPAC Namecumene;methane;4-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1,3-benzothiazole;bis(propan-2-ylcyclohexane);bis(propan-2-ylcyclopentane);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-yl-2H-pyrrole;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,2,4-thiadiazole;bis(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;5-propan-2-yl-1H-1,2,4-triazole
SMILESC.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)C1=NCC=C1.CC(C)C1=NCC=N1.CC(C)C1CCCC1.CC(C)C1CCCC1.CC(C)C1CCCCC1.CC(C)C1CCCCC1.CC(C)N1CCCC1.CC(C)c1cccc2c1OCO2.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1ccccn1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1cccnc1.CC(C)c1ccco1.CC(C)c1cccs1.CC(C)c1ccn[nH]1.CC(C)c1ccno1.CC(C)c1cnc[nH]1.CC(C)c1cnccn1.CC(C)c1cncs1.CC(C)c1cscn1.CC(C)c1nc2ccccc2s1.CC(C)c1ncc[nH]1.CC(C)c1ncccn1.CC(C)c1ncco1.CC(C)c1ncco1.CC(C)c1nccs1.CC(C)c1nccs1.CC(C)c1ncn[nH]1.CC(C)c1ncns1
InChIInChI=1S/C10H11NS.C10H12O2.2C9H18.2C9H12.5C8H11N.2C8H16.2C7H10N2.C7H15N.C7H11N.C7H10O.C7H10S.4C6H10N2.3C6H9NO.4C6H9NS.C5H9N3.C5H8N2S.18CH4/c1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-7(2)8-4-3-5-9-10(8)12-6-11-9;4*1-8(2)9-6-4-3-5-7-9;2*1-7(2)8-4-3-5-9-6-8;3*1-7(2)8-5-3-4-6-9-8;2*1-7(2)8-5-3-4-6-8;1-6(2)7-5-8-3-4-9-7;1-6(2)7-8-4-3-5-9-7;1-7(2)8-5-3-4-6-8;3*1-6(2)7-4-3-5-8-7;1-5(2)6-3-7-4-8-6;2*1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-7-8-6;2*1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-7-8-6;1-5(2)6-3-8-4-7-6;1-5(2)6-3-7-4-8-6;2*1-5(2)6-7-3-4-8-6;2*1-4(2)5-6-3-7-8-5;;;;;;;;;;;;;;;;;;/h3-7H,1-2H3;3-5,7H,6H2,1-2H3;2*8-9H,3-7H2,1-2H3;2*3-8H,1-2H3;5*3-7H,1-2H3;2*7-8H,3-6H2,1-2H3;2*3-6H,1-2H3;7H,3-6H2,1-2H3;3-4,6H,5H2,1-2H3;2*3-6H,1-2H3;3-5H,1-2H3,(H,7,8);3,5H,4H2,1-2H3;2*3-5H,1-2H3,(H,7,8);7*3-5H,1-2H3;3-4H,1-2H3,(H,6,7,8);3-4H,1-2H3;18*1H4
InChIKeyIUBIIGKFGQHTKR-UHFFFAOYSA-N
XLogP80.56
TPSA483.86 Ų
H-Bond Donors4
H-Bond Acceptors41
Rotatable Bonds32
Heavy Atoms293
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004178.84
LogP ≤ 580.56
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1041

Analyze cumene;methane;4-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1,3-benzothiazole;bis(propan-2-ylcyclohexane);bis(propan-2-ylcyclopentane);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-yl-2H-pyrrole;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,2,4-thiadiazole;bis(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;5-propan-2-yl-1H-1,2,4-triazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of cumene;methane;4-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1,3-benzothiazole;bis(propan-2-ylcyclohexane);bis(propan-2-ylcyclopentane);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-yl-2H-pyrrole;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,2,4-thiadiazole;bis(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;5-propan-2-yl-1H-1,2,4-triazole?
The IUPAC name of cumene;methane;4-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1,3-benzothiazole;bis(propan-2-ylcyclohexane);bis(propan-2-ylcyclopentane);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-yl-2H-pyrrole;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,2,4-thiadiazole;bis(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;5-propan-2-yl-1H-1,2,4-triazole (CID 158805826) is cumene;methane;4-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1,3-benzothiazole;bis(propan-2-ylcyclohexane);bis(propan-2-ylcyclopentane);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-yl-2H-pyrrole;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,2,4-thiadiazole;bis(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;5-propan-2-yl-1H-1,2,4-triazole.
What is the SMILES notation for cumene;methane;4-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1,3-benzothiazole;bis(propan-2-ylcyclohexane);bis(propan-2-ylcyclopentane);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-yl-2H-pyrrole;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,2,4-thiadiazole;bis(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;5-propan-2-yl-1H-1,2,4-triazole?
The canonical SMILES for cumene;methane;4-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1,3-benzothiazole;bis(propan-2-ylcyclohexane);bis(propan-2-ylcyclopentane);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-yl-2H-pyrrole;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,2,4-thiadiazole;bis(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;5-propan-2-yl-1H-1,2,4-triazole is C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.C.CC(C)C1=NCC=C1.CC(C)C1=NCC=N1.CC(C)C1CCCC1.CC(C)C1CCCC1.CC(C)C1CCCCC1.CC(C)C1CCCCC1.CC(C)N1CCCC1.CC(C)c1cccc2c1OCO2.CC(C)c1ccccc1.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1ccccn1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1cccnc1.CC(C)c1ccco1.CC(C)c1cccs1.CC(C)c1ccn[nH]1.CC(C)c1ccno1.CC(C)c1cnc[nH]1.CC(C)c1cnccn1.CC(C)c1cncs1.CC(C)c1cscn1.CC(C)c1nc2ccccc2s1.CC(C)c1ncc[nH]1.CC(C)c1ncccn1.CC(C)c1ncco1.CC(C)c1ncco1.CC(C)c1nccs1.CC(C)c1nccs1.CC(C)c1ncn[nH]1.CC(C)c1ncns1.
What is the InChIKey of cumene;methane;4-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1,3-benzothiazole;bis(propan-2-ylcyclohexane);bis(propan-2-ylcyclopentane);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-yl-2H-pyrrole;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,2,4-thiadiazole;bis(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;5-propan-2-yl-1H-1,2,4-triazole?
The InChIKey is IUBIIGKFGQHTKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NS.C10H12O2.2C9H18.2C9H12.5C8H11N.2C8H16.2C7H10N2.C7H15N.C7H11N.C7H10O.C7H10S.4C6H10N2.3C6H9NO.4C6H9NS.C5H9N3.C5H8N2S.18CH4/c1-7(2)10-11-8-5-3-4-6-9(8)12-10;1-7(2)8-4-3-5-9-10(8)12-6-11-9;4*1-8(2)9-6-4-3-5-7-9;2*1-7(2)8-4-3-5-9-6-8;3*1-7(2)8-5-3-4-6-9-8;2*1-7(2)8-5-3-4-6-8;1-6(2)7-5-8-3-4-9-7;1-6(2)7-8-4-3-5-9-7;1-7(2)8-5-3-4-6-8;3*1-6(2)7-4-3-5-8-7;1-5(2)6-3-7-4-8-6;2*1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-7-8-6;2*1-5(2)6-7-3-4-8-6;1-5(2)6-3-4-7-8-6;1-5(2)6-3-8-4-7-6;1-5(2)6-3-7-4-8-6;2*1-5(2)6-7-3-4-8-6;2*1-4(2)5-6-3-7-8-5;;;;;;;;;;;;;;;;;;/h3-7H,1-2H3;3-5,7H,6H2,1-2H3;2*8-9H,3-7H2,1-2H3;2*3-8H,1-2H3;5*3-7H,1-2H3;2*7-8H,3-6H2,1-2H3;2*3-6H,1-2H3;7H,3-6H2,1-2H3;3-4,6H,5H2,1-2H3;2*3-6H,1-2H3;3-5H,1-2H3,(H,7,8);3,5H,4H2,1-2H3;2*3-5H,1-2H3,(H,7,8);7*3-5H,1-2H3;3-4H,1-2H3,(H,6,7,8);3-4H,1-2H3;18*1H4.
What are the key properties of cumene;methane;4-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1,3-benzothiazole;bis(propan-2-ylcyclohexane);bis(propan-2-ylcyclopentane);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-yl-2H-pyrrole;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,2,4-thiadiazole;bis(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;5-propan-2-yl-1H-1,2,4-triazole?
cumene;methane;4-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1,3-benzothiazole;bis(propan-2-ylcyclohexane);bis(propan-2-ylcyclopentane);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-yl-2H-pyrrole;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,2,4-thiadiazole;bis(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;5-propan-2-yl-1H-1,2,4-triazole has a molecular weight of 4178.84 g/mol, XLogP of 80.56, 32 rotatable bonds, 4 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for cumene;methane;4-propan-2-yl-1,3-benzodioxole;2-propan-2-yl-1,3-benzothiazole;bis(propan-2-ylcyclohexane);bis(propan-2-ylcyclopentane);2-propan-2-ylfuran;2-propan-2-yl-1H-imidazole;2-propan-2-yl-4H-imidazole;5-propan-2-yl-1H-imidazole;bis(2-propan-2-yl-1,3-oxazole);5-propan-2-yl-1,2-oxazole;2-propan-2-ylpyrazine;5-propan-2-yl-1H-pyrazole;tris(2-propan-2-ylpyridine);bis(3-propan-2-ylpyridine);2-propan-2-ylpyrimidine;5-propan-2-yl-2H-pyrrole;1-propan-2-ylpyrrolidine;5-propan-2-yl-1,2,4-thiadiazole;bis(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;5-propan-2-yl-1H-1,2,4-triazole is sourced from PubChem (CID 158805826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).