2,3-dimethylbutane;ethane;ethanone;1-fluoro-2-methylpropane;2-methanidylpropane;2-methylbutane;5-methyl-1-(2-methylpropyl)indole;2-methylpropylbenzene;bis(3-(2-methylpropyl)-1H-indole);4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrazole;4-(2-methylpropyl)pyridine;propan-2-ylcyclohexane;propan-2-ylcyclopentane;propan-2-ylcyclopropane;1,1,1-trifluoro-3-methylbutane;yttrium

C122H211F4N7O2Y-2 — CID 159840468

About 2,3-dimethylbutane;ethane;ethanone;1-fluoro-2-methylpropane;2-methanidylpropane;2-methylbutane;5-methyl-1-(2-methylpropyl)indole;2-methylpropylbenzene;bis(3-(2-methylpropyl)-1H-indole);4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrazole;4-(2-methylpropyl)pyridine;propan-2-ylcyclohexane;propan-2-ylcyclopentane;propan-2-ylcyclopropane;1,1,1-trifluoro-3-methylbutane;yttrium

2,3-dimethylbutane;ethane;ethanone;1-fluoro-2-methylpropane;2-methanidylpropane;2-methylbutane;5-methyl-1-(2-methylpropyl)indole;2-methylpropylbenzene;bis(3-(2-methylpropyl)-1H-indole);4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrazole;4-(2-methylpropyl)pyridine;propan-2-ylcyclohexane;propan-2-ylcyclopentane;propan-2-ylcyclopropane;1,1,1-trifluoro-3-methylbutane;yttrium (PubChem CID 159840468) has the molecular formula C122H211F4N7O2Y-2 and a molecular weight of 1972.97 g/mol. Its IUPAC name is 2,3-dimethylbutane;ethane;ethanone;1-fluoro-2-methylpropane;2-methanidylpropane;2-methylbutane;5-methyl-1-(2-methylpropyl)indole;2-methylpropylbenzene;bis(3-(2-methylpropyl)-1H-indole);4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrazole;4-(2-methylpropyl)pyridine;propan-2-ylcyclohexane;propan-2-ylcyclopentane;propan-2-ylcyclopropane;1,1,1-trifluoro-3-methylbutane;yttrium.

Molecular Properties

• Compound Name: 2,3-dimethylbutane;ethane;ethanone;1-fluoro-2-methylpropane;2-methanidylpropane;2-methylbutane;5-methyl-1-(2-methylpropyl)indole;2-methylpropylbenzene;bis(3-(2-methylpropyl)-1H-indole);4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrazole;4-(2-methylpropyl)pyridine;propan-2-ylcyclohexane;propan-2-ylcyclopentane;propan-2-ylcyclopropane;1,1,1-trifluoro-3-methylbutane;yttrium
• PubChem CID: 159840468
• Molecular Formula: C122H211F4N7O2Y-2
• Molecular Weight: 1972.97 g/mol
• Exact Mass: 1971.56
• IUPAC Name: 2,3-dimethylbutane;ethane;ethanone;1-fluoro-2-methylpropane;2-methanidylpropane;2-methylbutane;5-methyl-1-(2-methylpropyl)indole;2-methylpropylbenzene;bis(3-(2-methylpropyl)-1H-indole);4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrazole;4-(2-methylpropyl)pyridine;propan-2-ylcyclohexane;propan-2-ylcyclopentane;propan-2-ylcyclopropane;1,1,1-trifluoro-3-methylbutane;yttrium
• SMILES: CC.CC(C)C(C)C.CC(C)C1CC1.CC(C)C1CCCC1.CC(C)C1CCCCC1.CC(C)CC(F)(F)F.CC(C)CF.CC(C)CN1CCOCC1.CC(C)Cc1c[nH]c2ccccc12.CC(C)Cc1c[nH]c2ccccc12.CC(C)Cc1ccccc1.CC(C)Cc1ccncc1.CC(C)Cn1cccn1.CCC(C)C.C[C-]=O.Cc1ccc2c(ccn2CC(C)C)c1.[CH2-]C(C)C.[Y]
• InChI: InChI=1S/C13H17N.2C12H15N.C10H14.C9H13N.C9H18.C8H17NO.C8H16.C7H12N2.C6H12.C6H14.C5H9F3.C5H12.C4H9F.C4H9.C2H3O.C2H6.Y/c1-10(2)9-14-7-6-12-8-11(3)4-5-13(12)14;2*1-9(2)7-10-8-13-12-6-4-3-5-11(10)12;1-9(2)8-10-6-4-3-5-7-10;1-8(2)7-9-3-5-10-6-4-9;1-8(2)9-6-4-3-5-7-9;1-8(2)7-9-3-5-10-6-4-9;1-7(2)8-5-3-4-6-8;1-7(2)6-9-5-3-4-8-9;1-5(2)6-3-4-6;1-5(2)6(3)4;1-4(2)3-5(6,7)8;1-4-5(2)3;1-4(2)3-5;1-4(2)3;1-2-3;1-2;/h4-8,10H,9H2,1-3H3;2*3-6,8-9,13H,7H2,1-2H3;3-7,9H,8H2,1-2H3;3-6,8H,7H2,1-2H3;8-9H,3-7H2,1-2H3;8H,3-7H2,1-2H3;7-8H,3-6H2,1-2H3;3-5,7H,6H2,1-2H3;5-6H,3-4H2,1-2H3;5-6H,1-4H3;4H,3H2,1-2H3;5H,4H2,1-3H3;4H,3H2,1-2H3;4H,1H2,2-3H3;1H3;1-2H3;/q;;;;;;;;;;;;;;2*-1
• InChIKey: VBRWCJPBHZEPSM-UHFFFAOYSA-N
• XLogP: 37.30
• TPSA: 96.76 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 7
• Rotatable Bonds: 21
• Heavy Atoms: 136
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1972.97
LogP ≤ 5	37.30
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	7

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylbutane;ethane;ethanone;1-fluoro-2-methylpropane;2-methanidylpropane;2-methylbutane;5-methyl-1-(2-methylpropyl)indole;2-methylpropylbenzene;bis(3-(2-methylpropyl)-1H-indole);4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrazole;4-(2-methylpropyl)pyridine;propan-2-ylcyclohexane;propan-2-ylcyclopentane;propan-2-ylcyclopropane;1,1,1-trifluoro-3-methylbutane;yttrium?

The IUPAC name of 2,3-dimethylbutane;ethane;ethanone;1-fluoro-2-methylpropane;2-methanidylpropane;2-methylbutane;5-methyl-1-(2-methylpropyl)indole;2-methylpropylbenzene;bis(3-(2-methylpropyl)-1H-indole);4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrazole;4-(2-methylpropyl)pyridine;propan-2-ylcyclohexane;propan-2-ylcyclopentane;propan-2-ylcyclopropane;1,1,1-trifluoro-3-methylbutane;yttrium (CID 159840468) is 2,3-dimethylbutane;ethane;ethanone;1-fluoro-2-methylpropane;2-methanidylpropane;2-methylbutane;5-methyl-1-(2-methylpropyl)indole;2-methylpropylbenzene;bis(3-(2-methylpropyl)-1H-indole);4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrazole;4-(2-methylpropyl)pyridine;propan-2-ylcyclohexane;propan-2-ylcyclopentane;propan-2-ylcyclopropane;1,1,1-trifluoro-3-methylbutane;yttrium.

What is the SMILES notation for 2,3-dimethylbutane;ethane;ethanone;1-fluoro-2-methylpropane;2-methanidylpropane;2-methylbutane;5-methyl-1-(2-methylpropyl)indole;2-methylpropylbenzene;bis(3-(2-methylpropyl)-1H-indole);4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrazole;4-(2-methylpropyl)pyridine;propan-2-ylcyclohexane;propan-2-ylcyclopentane;propan-2-ylcyclopropane;1,1,1-trifluoro-3-methylbutane;yttrium?

The canonical SMILES for 2,3-dimethylbutane;ethane;ethanone;1-fluoro-2-methylpropane;2-methanidylpropane;2-methylbutane;5-methyl-1-(2-methylpropyl)indole;2-methylpropylbenzene;bis(3-(2-methylpropyl)-1H-indole);4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrazole;4-(2-methylpropyl)pyridine;propan-2-ylcyclohexane;propan-2-ylcyclopentane;propan-2-ylcyclopropane;1,1,1-trifluoro-3-methylbutane;yttrium is CC.CC(C)C(C)C.CC(C)C1CC1.CC(C)C1CCCC1.CC(C)C1CCCCC1.CC(C)CC(F)(F)F.CC(C)CF.CC(C)CN1CCOCC1.CC(C)Cc1c[nH]c2ccccc12.CC(C)Cc1c[nH]c2ccccc12.CC(C)Cc1ccccc1.CC(C)Cc1ccncc1.CC(C)Cn1cccn1.CCC(C)C.C[C-]=O.Cc1ccc2c(ccn2CC(C)C)c1.[CH2-]C(C)C.[Y].

What is the InChIKey of 2,3-dimethylbutane;ethane;ethanone;1-fluoro-2-methylpropane;2-methanidylpropane;2-methylbutane;5-methyl-1-(2-methylpropyl)indole;2-methylpropylbenzene;bis(3-(2-methylpropyl)-1H-indole);4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrazole;4-(2-methylpropyl)pyridine;propan-2-ylcyclohexane;propan-2-ylcyclopentane;propan-2-ylcyclopropane;1,1,1-trifluoro-3-methylbutane;yttrium?

The InChIKey is VBRWCJPBHZEPSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N.2C12H15N.C10H14.C9H13N.C9H18.C8H17NO.C8H16.C7H12N2.C6H12.C6H14.C5H9F3.C5H12.C4H9F.C4H9.C2H3O.C2H6.Y/c1-10(2)9-14-7-6-12-8-11(3)4-5-13(12)14;2*1-9(2)7-10-8-13-12-6-4-3-5-11(10)12;1-9(2)8-10-6-4-3-5-7-10;1-8(2)7-9-3-5-10-6-4-9;1-8(2)9-6-4-3-5-7-9;1-8(2)7-9-3-5-10-6-4-9;1-7(2)8-5-3-4-6-8;1-7(2)6-9-5-3-4-8-9;1-5(2)6-3-4-6;1-5(2)6(3)4;1-4(2)3-5(6,7)8;1-4-5(2)3;1-4(2)3-5;1-4(2)3;1-2-3;1-2;/h4-8,10H,9H2,1-3H3;2*3-6,8-9,13H,7H2,1-2H3;3-7,9H,8H2,1-2H3;3-6,8H,7H2,1-2H3;8-9H,3-7H2,1-2H3;8H,3-7H2,1-2H3;7-8H,3-6H2,1-2H3;3-5,7H,6H2,1-2H3;5-6H,3-4H2,1-2H3;5-6H,1-4H3;4H,3H2,1-2H3;5H,4H2,1-3H3;4H,3H2,1-2H3;4H,1H2,2-3H3;1H3;1-2H3;/q;;;;;;;;;;;;;;2*-1;;.

What are the key properties of 2,3-dimethylbutane;ethane;ethanone;1-fluoro-2-methylpropane;2-methanidylpropane;2-methylbutane;5-methyl-1-(2-methylpropyl)indole;2-methylpropylbenzene;bis(3-(2-methylpropyl)-1H-indole);4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrazole;4-(2-methylpropyl)pyridine;propan-2-ylcyclohexane;propan-2-ylcyclopentane;propan-2-ylcyclopropane;1,1,1-trifluoro-3-methylbutane;yttrium?

2,3-dimethylbutane;ethane;ethanone;1-fluoro-2-methylpropane;2-methanidylpropane;2-methylbutane;5-methyl-1-(2-methylpropyl)indole;2-methylpropylbenzene;bis(3-(2-methylpropyl)-1H-indole);4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrazole;4-(2-methylpropyl)pyridine;propan-2-ylcyclohexane;propan-2-ylcyclopentane;propan-2-ylcyclopropane;1,1,1-trifluoro-3-methylbutane;yttrium has a molecular weight of 1972.97 g/mol, XLogP of 37.30, 21 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 2,3-dimethylbutane;ethane;ethanone;1-fluoro-2-methylpropane;2-methanidylpropane;2-methylbutane;5-methyl-1-(2-methylpropyl)indole;2-methylpropylbenzene;bis(3-(2-methylpropyl)-1H-indole);4-(2-methylpropyl)morpholine;1-(2-methylpropyl)pyrazole;4-(2-methylpropyl)pyridine;propan-2-ylcyclohexane;propan-2-ylcyclopentane;propan-2-ylcyclopropane;1,1,1-trifluoro-3-methylbutane;yttrium is sourced from PubChem (CID 159840468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).