(3-methanidyl-3-methylbutyl)-(2,3,3-trimethylbutan-2-yl)azanide;yttrium

C13H27NY-2 — CID 59881198

IUPAC(3-methanidyl-3-methylbutyl)-(2,3,3-trimethylbutan-2-yl)azanide;yttrium
SMILES[CH2-]C(C)(C)CC[N-]C(C)(C)C(C)(C)C.[Y]
InChIInChI=1S/C13H27N.Y/c1-11(2,3)9-10-14-13(7,8)12(4,5)6;/h1,9-10H2,2-8H3;/q-2;
InChIKeyJPPOZXOBZPKQIF-UHFFFAOYSA-N
MW286.27 g/mol
LogP4.43
Rot. Bonds4

About (3-methanidyl-3-methylbutyl)-(2,3,3-trimethylbutan-2-yl)azanide;yttrium

(3-methanidyl-3-methylbutyl)-(2,3,3-trimethylbutan-2-yl)azanide;yttrium (PubChem CID 59881198) has the molecular formula C13H27NY-2 and a molecular weight of 286.27 g/mol. Its IUPAC name is (3-methanidyl-3-methylbutyl)-(2,3,3-trimethylbutan-2-yl)azanide;yttrium.

Molecular Properties

Compound Name(3-methanidyl-3-methylbutyl)-(2,3,3-trimethylbutan-2-yl)azanide;yttrium
PubChem CID59881198
Molecular FormulaC13H27NY-2
Molecular Weight286.27 g/mol
Exact Mass286.12
IUPAC Name(3-methanidyl-3-methylbutyl)-(2,3,3-trimethylbutan-2-yl)azanide;yttrium
SMILES[CH2-]C(C)(C)CC[N-]C(C)(C)C(C)(C)C.[Y]
InChIInChI=1S/C13H27N.Y/c1-11(2,3)9-10-14-13(7,8)12(4,5)6;/h1,9-10H2,2-8H3;/q-2;
InChIKeyJPPOZXOBZPKQIF-UHFFFAOYSA-N
XLogP4.43
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.27
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-methanidyl-2-methylpropane;rhenium;yttrium
CID 58594735
tert-butyl(ethyl)azanide;ethane;yttrium
CID 158619467
dilithium;tert-butyl(2-tert-butylazanidylethyl)azanide
CID 59557620
bis(tert-butyl(2-tert-butylazanidylethyl)azanide);titanium(4+)
CID 87935492
tert-butyl(2-tert-butylazanidylethyl)azanide;manganese(2+)
CID 140844875
bis(2-methanidyl-2-methylpropane);bis(2-methylpropane);bis(yttrium)
CID 165071362
dilithium;2-methanidyl-2-methylpropane
CID 14120101
tert-butylphosphanium chloride
CID 23318676
2-methanidyl-2-methylpropane;palladium
CID 163183764
lithium 2-methanidyl-2-methylpropane
CID 10898631
manganese;2-methanidyl-2-methylpropane
CID 15914338
potassium 3-methanidyl-3-methylpentan-1-amine
CID 171657081

Frequently Asked Questions

What is the IUPAC name of (3-methanidyl-3-methylbutyl)-(2,3,3-trimethylbutan-2-yl)azanide;yttrium?
The IUPAC name of (3-methanidyl-3-methylbutyl)-(2,3,3-trimethylbutan-2-yl)azanide;yttrium (CID 59881198) is (3-methanidyl-3-methylbutyl)-(2,3,3-trimethylbutan-2-yl)azanide;yttrium.
What is the SMILES notation for (3-methanidyl-3-methylbutyl)-(2,3,3-trimethylbutan-2-yl)azanide;yttrium?
The canonical SMILES for (3-methanidyl-3-methylbutyl)-(2,3,3-trimethylbutan-2-yl)azanide;yttrium is [CH2-]C(C)(C)CC[N-]C(C)(C)C(C)(C)C.[Y].
What is the InChIKey of (3-methanidyl-3-methylbutyl)-(2,3,3-trimethylbutan-2-yl)azanide;yttrium?
The InChIKey is JPPOZXOBZPKQIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N.Y/c1-11(2,3)9-10-14-13(7,8)12(4,5)6;/h1,9-10H2,2-8H3;/q-2;.
What are the key properties of (3-methanidyl-3-methylbutyl)-(2,3,3-trimethylbutan-2-yl)azanide;yttrium?
(3-methanidyl-3-methylbutyl)-(2,3,3-trimethylbutan-2-yl)azanide;yttrium has a molecular weight of 286.27 g/mol, XLogP of 4.43, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methanidyl-3-methylbutyl)-(2,3,3-trimethylbutan-2-yl)azanide;yttrium is sourced from PubChem (CID 59881198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).