2-(ethylamino)-2-methylpropan-1-ol;1,2,3,4,5,6-hexamethylbenzene;ruthenium(3+)

C18H33NORu+3 — CID 56947660

IUPAC2-(ethylamino)-2-methylpropan-1-ol;1,2,3,4,5,6-hexamethylbenzene;ruthenium(3+)
SMILESCCNC(C)(C)CO.Cc1c(C)c(C)c(C)c(C)c1C.[Ru+3]
InChIInChI=1S/C12H18.C6H15NO.Ru/c1-7-8(2)10(4)12(6)11(5)9(7)3;1-4-7-6(2,3)5-8;/h1-6H3;7-8H,4-5H2,1-3H3;/q;;+3
InChIKeyPZUIPEALXWEFLX-UHFFFAOYSA-N
MW380.54 g/mol
LogP3.90
Rot. Bonds3

About 2-(ethylamino)-2-methylpropan-1-ol;1,2,3,4,5,6-hexamethylbenzene;ruthenium(3+)

2-(ethylamino)-2-methylpropan-1-ol;1,2,3,4,5,6-hexamethylbenzene;ruthenium(3+) (PubChem CID 56947660) has the molecular formula C18H33NORu+3 and a molecular weight of 380.54 g/mol. Its IUPAC name is 2-(ethylamino)-2-methylpropan-1-ol;1,2,3,4,5,6-hexamethylbenzene;ruthenium(3+).

Molecular Properties

Compound Name2-(ethylamino)-2-methylpropan-1-ol;1,2,3,4,5,6-hexamethylbenzene;ruthenium(3+)
PubChem CID56947660
Molecular FormulaC18H33NORu+3
Molecular Weight380.54 g/mol
Exact Mass381.16
IUPAC Name2-(ethylamino)-2-methylpropan-1-ol;1,2,3,4,5,6-hexamethylbenzene;ruthenium(3+)
SMILESCCNC(C)(C)CO.Cc1c(C)c(C)c(C)c(C)c1C.[Ru+3]
InChIInChI=1S/C12H18.C6H15NO.Ru/c1-7-8(2)10(4)12(6)11(5)9(7)3;1-4-7-6(2,3)5-8;/h1-6H3;7-8H,4-5H2,1-3H3;/q;;+3
InChIKeyPZUIPEALXWEFLX-UHFFFAOYSA-N
XLogP3.90
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.54
LogP ≤ 53.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(ethylamino)-2-methylpropan-1-ol
CID 15105174
2-[[(1-hydroxy-2-methylpropan-2-yl)amino]methylamino]-2-methylpropan-1-ol;methane
CID 158688440
2-(2,2-dimethylpentylamino)-2-methylpropan-1-ol
CID 115133723
2-methyl-2-[(2,3,5,6-tetramethylphenyl)methylamino]propan-1-ol
CID 115133367
2-methyl-2-(2-methylbutylamino)propan-1-ol
CID 43207248
2-methyl-2-[2-(methylamino)ethylamino]propan-1-ol
CID 132887947
2-(ethylamino)-2-(4-methylphenyl)propan-1-ol
CID 61048119
2-[(2-ethylphenyl)methylamino]-2-methylpropan-1-ol
CID 62391565
2-[[2-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol
CID 58721712
2-[[2-amino-3-(tert-butylamino)-2-methylpropyl]amino]-2-methylpropan-1-ol
CID 134891098
2-[(4-methoxy-3,5-dimethylphenyl)methylamino]-2-methylpropan-1-ol
CID 111112626
2-methyl-2-[[2-methyl-2-(5-methylfuran-2-yl)propyl]amino]propan-1-ol
CID 115133777

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-2-methylpropan-1-ol;1,2,3,4,5,6-hexamethylbenzene;ruthenium(3+)?
The IUPAC name of 2-(ethylamino)-2-methylpropan-1-ol;1,2,3,4,5,6-hexamethylbenzene;ruthenium(3+) (CID 56947660) is 2-(ethylamino)-2-methylpropan-1-ol;1,2,3,4,5,6-hexamethylbenzene;ruthenium(3+).
What is the SMILES notation for 2-(ethylamino)-2-methylpropan-1-ol;1,2,3,4,5,6-hexamethylbenzene;ruthenium(3+)?
The canonical SMILES for 2-(ethylamino)-2-methylpropan-1-ol;1,2,3,4,5,6-hexamethylbenzene;ruthenium(3+) is CCNC(C)(C)CO.Cc1c(C)c(C)c(C)c(C)c1C.[Ru+3].
What is the InChIKey of 2-(ethylamino)-2-methylpropan-1-ol;1,2,3,4,5,6-hexamethylbenzene;ruthenium(3+)?
The InChIKey is PZUIPEALXWEFLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18.C6H15NO.Ru/c1-7-8(2)10(4)12(6)11(5)9(7)3;1-4-7-6(2,3)5-8;/h1-6H3;7-8H,4-5H2,1-3H3;/q;;+3.
What are the key properties of 2-(ethylamino)-2-methylpropan-1-ol;1,2,3,4,5,6-hexamethylbenzene;ruthenium(3+)?
2-(ethylamino)-2-methylpropan-1-ol;1,2,3,4,5,6-hexamethylbenzene;ruthenium(3+) has a molecular weight of 380.54 g/mol, XLogP of 3.90, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-2-methylpropan-1-ol;1,2,3,4,5,6-hexamethylbenzene;ruthenium(3+) is sourced from PubChem (CID 56947660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).