pentakis(tert-butyl(1-tert-butylazanidylethyl)azanide);1-[butyl(ethyl)amino]-2-methylpropan-2-ol;1-[butyl(methyl)amino]-2-methylpropan-2-ol;1-(dibutylamino)-2-methylpropan-2-ol;1-(diethylamino)-2-methylpropan-2-ol;1-(dimethylamino)-2-methylbutan-2-ol;pentakis(nickel(2+))

C96H217N15Ni5O5 — CID 161138025

IUPACpentakis(tert-butyl(1-tert-butylazanidylethyl)azanide);1-[butyl(ethyl)amino]-2-methylpropan-2-ol;1-[butyl(methyl)amino]-2-methylpropan-2-ol;1-(dibutylamino)-2-methylpropan-2-ol;1-(diethylamino)-2-methylpropan-2-ol;1-(dimethylamino)-2-methylbutan-2-ol;pentakis(nickel(2+))
SMILESCC([N-]C(C)(C)C)[N-]C(C)(C)C.CC([N-]C(C)(C)C)[N-]C(C)(C)C.CC([N-]C(C)(C)C)[N-]C(C)(C)C.CC([N-]C(C)(C)C)[N-]C(C)(C)C.CC([N-]C(C)(C)C)[N-]C(C)(C)C.CCC(C)(O)CN(C)C.CCCCN(C)CC(C)(C)O.CCCCN(CC)CC(C)(C)O.CCCCN(CCCC)CC(C)(C)O.CCN(CC)CC(C)(C)O.[Ni+2].[Ni+2].[Ni+2].[Ni+2].[Ni+2]
InChIInChI=1S/C12H27NO.5C10H22N2.C10H23NO.C9H21NO.C8H19NO.C7H17NO.5Ni/c1-5-7-9-13(10-8-6-2)11-12(3,4)14;5*1-8(11-9(2,3)4)12-10(5,6)7;1-5-7-8-11(6-2)9-10(3,4)12;1-5-6-7-10(4)8-9(2,3)11;1-5-9(6-2)7-8(3,4)10;1-5-7(2,9)6-8(3)4;;;;;/h14H,5-11H2,1-4H3;5*8H,1-7H3;12H,5-9H2,1-4H3;11H,5-8H2,1-4H3;10H,5-7H2,1-4H3;9H,5-6H2,1-4H3;;;;;/q;5*-2;;;;;5*+2
InChIKeyUMTVKEVGABCVLS-UHFFFAOYSA-N
MW1955.36 g/mol
LogP26.21
Rot. Bonds36

About pentakis(tert-butyl(1-tert-butylazanidylethyl)azanide);1-[butyl(ethyl)amino]-2-methylpropan-2-ol;1-[butyl(methyl)amino]-2-methylpropan-2-ol;1-(dibutylamino)-2-methylpropan-2-ol;1-(diethylamino)-2-methylpropan-2-ol;1-(dimethylamino)-2-methylbutan-2-ol;pentakis(nickel(2+))

pentakis(tert-butyl(1-tert-butylazanidylethyl)azanide);1-[butyl(ethyl)amino]-2-methylpropan-2-ol;1-[butyl(methyl)amino]-2-methylpropan-2-ol;1-(dibutylamino)-2-methylpropan-2-ol;1-(diethylamino)-2-methylpropan-2-ol;1-(dimethylamino)-2-methylbutan-2-ol;pentakis(nickel(2+)) (PubChem CID 161138025) has the molecular formula C96H217N15Ni5O5 and a molecular weight of 1955.36 g/mol. Its IUPAC name is pentakis(tert-butyl(1-tert-butylazanidylethyl)azanide);1-[butyl(ethyl)amino]-2-methylpropan-2-ol;1-[butyl(methyl)amino]-2-methylpropan-2-ol;1-(dibutylamino)-2-methylpropan-2-ol;1-(diethylamino)-2-methylpropan-2-ol;1-(dimethylamino)-2-methylbutan-2-ol;pentakis(nickel(2+)).

Molecular Properties

Compound Namepentakis(tert-butyl(1-tert-butylazanidylethyl)azanide);1-[butyl(ethyl)amino]-2-methylpropan-2-ol;1-[butyl(methyl)amino]-2-methylpropan-2-ol;1-(dibutylamino)-2-methylpropan-2-ol;1-(diethylamino)-2-methylpropan-2-ol;1-(dimethylamino)-2-methylbutan-2-ol;pentakis(nickel(2+))
PubChem CID161138025
Molecular FormulaC96H217N15Ni5O5
Molecular Weight1955.36 g/mol
Exact Mass1950.40
IUPAC Namepentakis(tert-butyl(1-tert-butylazanidylethyl)azanide);1-[butyl(ethyl)amino]-2-methylpropan-2-ol;1-[butyl(methyl)amino]-2-methylpropan-2-ol;1-(dibutylamino)-2-methylpropan-2-ol;1-(diethylamino)-2-methylpropan-2-ol;1-(dimethylamino)-2-methylbutan-2-ol;pentakis(nickel(2+))
SMILESCC([N-]C(C)(C)C)[N-]C(C)(C)C.CC([N-]C(C)(C)C)[N-]C(C)(C)C.CC([N-]C(C)(C)C)[N-]C(C)(C)C.CC([N-]C(C)(C)C)[N-]C(C)(C)C.CC([N-]C(C)(C)C)[N-]C(C)(C)C.CCC(C)(O)CN(C)C.CCCCN(C)CC(C)(C)O.CCCCN(CC)CC(C)(C)O.CCCCN(CCCC)CC(C)(C)O.CCN(CC)CC(C)(C)O.[Ni+2].[Ni+2].[Ni+2].[Ni+2].[Ni+2]
InChIInChI=1S/C12H27NO.5C10H22N2.C10H23NO.C9H21NO.C8H19NO.C7H17NO.5Ni/c1-5-7-9-13(10-8-6-2)11-12(3,4)14;5*1-8(11-9(2,3)4)12-10(5,6)7;1-5-7-8-11(6-2)9-10(3,4)12;1-5-6-7-10(4)8-9(2,3)11;1-5-9(6-2)7-8(3,4)10;1-5-7(2,9)6-8(3)4;;;;;/h14H,5-11H2,1-4H3;5*8H,1-7H3;12H,5-9H2,1-4H3;11H,5-8H2,1-4H3;10H,5-7H2,1-4H3;9H,5-6H2,1-4H3;;;;;/q;5*-2;;;;;5*+2
InChIKeyUMTVKEVGABCVLS-UHFFFAOYSA-N
XLogP26.21
TPSA258.35 Ų
H-Bond Donors5
H-Bond Acceptors10
Rotatable Bonds36
Heavy Atoms121
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001955.36
LogP ≤ 526.21
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1010

Analyze pentakis(tert-butyl(1-tert-butylazanidylethyl)azanide);1-[butyl(ethyl)amino]-2-methylpropan-2-ol;1-[butyl(methyl)amino]-2-methylpropan-2-ol;1-(dibutylamino)-2-methylpropan-2-ol;1-(diethylamino)-2-methylpropan-2-ol;1-(dimethylamino)-2-methylbutan-2-ol;pentakis(nickel(2+)) with MolForge

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Related Compounds

1-[dodecyl(ethyl)amino]-2-methylpropan-2-ol
CID 79390324
1-[butyl-(2-hydroxy-2-methylpropyl)amino]-2-methylpropan-2-ol
CID 90370489
1-[ethyl-[2-(propan-2-ylamino)ethyl]amino]-2-methylpropan-2-ol
CID 79389739
1-[9-bromononyl(ethyl)amino]-2-methylpropan-2-ol
CID 105343823
5-[ethyl-(2-hydroxy-2-methylpropyl)amino]pentan-1-ol
CID 79047122
1-[2-aminoethyl(ethyl)amino]-2-methylpropan-2-ol
CID 79006123
1-(dimethylamino)-2-methylpropan-2-ol;ethane
CID 162022408
4-[butyl(methyl)amino]-3,3-dimethylbutan-2-one
CID 66453152
2-[[butyl(methyl)amino]methyl]-2-methylbutan-1-ol
CID 62271452
6-[ethyl-(2-hydroxy-2-methylpropyl)amino]hexan-3-one
CID 106801517
1-[ethyl-(2-hydroxy-2-methylpropyl)amino]-2,3-dimethylbutan-2-ol
CID 114448993
1-[ethyl(methyl)amino]-2-methylpropan-2-ol;titanium
CID 58881638

Frequently Asked Questions

What is the IUPAC name of pentakis(tert-butyl(1-tert-butylazanidylethyl)azanide);1-[butyl(ethyl)amino]-2-methylpropan-2-ol;1-[butyl(methyl)amino]-2-methylpropan-2-ol;1-(dibutylamino)-2-methylpropan-2-ol;1-(diethylamino)-2-methylpropan-2-ol;1-(dimethylamino)-2-methylbutan-2-ol;pentakis(nickel(2+))?
The IUPAC name of pentakis(tert-butyl(1-tert-butylazanidylethyl)azanide);1-[butyl(ethyl)amino]-2-methylpropan-2-ol;1-[butyl(methyl)amino]-2-methylpropan-2-ol;1-(dibutylamino)-2-methylpropan-2-ol;1-(diethylamino)-2-methylpropan-2-ol;1-(dimethylamino)-2-methylbutan-2-ol;pentakis(nickel(2+)) (CID 161138025) is pentakis(tert-butyl(1-tert-butylazanidylethyl)azanide);1-[butyl(ethyl)amino]-2-methylpropan-2-ol;1-[butyl(methyl)amino]-2-methylpropan-2-ol;1-(dibutylamino)-2-methylpropan-2-ol;1-(diethylamino)-2-methylpropan-2-ol;1-(dimethylamino)-2-methylbutan-2-ol;pentakis(nickel(2+)).
What is the SMILES notation for pentakis(tert-butyl(1-tert-butylazanidylethyl)azanide);1-[butyl(ethyl)amino]-2-methylpropan-2-ol;1-[butyl(methyl)amino]-2-methylpropan-2-ol;1-(dibutylamino)-2-methylpropan-2-ol;1-(diethylamino)-2-methylpropan-2-ol;1-(dimethylamino)-2-methylbutan-2-ol;pentakis(nickel(2+))?
The canonical SMILES for pentakis(tert-butyl(1-tert-butylazanidylethyl)azanide);1-[butyl(ethyl)amino]-2-methylpropan-2-ol;1-[butyl(methyl)amino]-2-methylpropan-2-ol;1-(dibutylamino)-2-methylpropan-2-ol;1-(diethylamino)-2-methylpropan-2-ol;1-(dimethylamino)-2-methylbutan-2-ol;pentakis(nickel(2+)) is CC([N-]C(C)(C)C)[N-]C(C)(C)C.CC([N-]C(C)(C)C)[N-]C(C)(C)C.CC([N-]C(C)(C)C)[N-]C(C)(C)C.CC([N-]C(C)(C)C)[N-]C(C)(C)C.CC([N-]C(C)(C)C)[N-]C(C)(C)C.CCC(C)(O)CN(C)C.CCCCN(C)CC(C)(C)O.CCCCN(CC)CC(C)(C)O.CCCCN(CCCC)CC(C)(C)O.CCN(CC)CC(C)(C)O.[Ni+2].[Ni+2].[Ni+2].[Ni+2].[Ni+2].
What is the InChIKey of pentakis(tert-butyl(1-tert-butylazanidylethyl)azanide);1-[butyl(ethyl)amino]-2-methylpropan-2-ol;1-[butyl(methyl)amino]-2-methylpropan-2-ol;1-(dibutylamino)-2-methylpropan-2-ol;1-(diethylamino)-2-methylpropan-2-ol;1-(dimethylamino)-2-methylbutan-2-ol;pentakis(nickel(2+))?
The InChIKey is UMTVKEVGABCVLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H27NO.5C10H22N2.C10H23NO.C9H21NO.C8H19NO.C7H17NO.5Ni/c1-5-7-9-13(10-8-6-2)11-12(3,4)14;5*1-8(11-9(2,3)4)12-10(5,6)7;1-5-7-8-11(6-2)9-10(3,4)12;1-5-6-7-10(4)8-9(2,3)11;1-5-9(6-2)7-8(3,4)10;1-5-7(2,9)6-8(3)4;;;;;/h14H,5-11H2,1-4H3;5*8H,1-7H3;12H,5-9H2,1-4H3;11H,5-8H2,1-4H3;10H,5-7H2,1-4H3;9H,5-6H2,1-4H3;;;;;/q;5*-2;;;;;5*+2.
What are the key properties of pentakis(tert-butyl(1-tert-butylazanidylethyl)azanide);1-[butyl(ethyl)amino]-2-methylpropan-2-ol;1-[butyl(methyl)amino]-2-methylpropan-2-ol;1-(dibutylamino)-2-methylpropan-2-ol;1-(diethylamino)-2-methylpropan-2-ol;1-(dimethylamino)-2-methylbutan-2-ol;pentakis(nickel(2+))?
pentakis(tert-butyl(1-tert-butylazanidylethyl)azanide);1-[butyl(ethyl)amino]-2-methylpropan-2-ol;1-[butyl(methyl)amino]-2-methylpropan-2-ol;1-(dibutylamino)-2-methylpropan-2-ol;1-(diethylamino)-2-methylpropan-2-ol;1-(dimethylamino)-2-methylbutan-2-ol;pentakis(nickel(2+)) has a molecular weight of 1955.36 g/mol, XLogP of 26.21, 36 rotatable bonds, 5 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for pentakis(tert-butyl(1-tert-butylazanidylethyl)azanide);1-[butyl(ethyl)amino]-2-methylpropan-2-ol;1-[butyl(methyl)amino]-2-methylpropan-2-ol;1-(dibutylamino)-2-methylpropan-2-ol;1-(diethylamino)-2-methylpropan-2-ol;1-(dimethylamino)-2-methylbutan-2-ol;pentakis(nickel(2+)) is sourced from PubChem (CID 161138025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).