N-[1-(methanidylideneamino)ethenyl]propan-2-amine;yttrium

C6H10N2Y-2 — CID 59037952

IUPACN-[1-(methanidylideneamino)ethenyl]propan-2-amine;yttrium
SMILES[H]/[C-]=N/C(=[C-]/[H])NC(C)C.[Y]
InChIInChI=1S/C6H10N2.Y/c1-5(2)8-6(3)7-4;/h3-5,8H,1-2H3;/q-2;
InChIKeyHETZHTFFSKJFEJ-UHFFFAOYSA-N
MW199.07 g/mol
LogP0.83
Rot. Bonds3

About N-[1-(methanidylideneamino)ethenyl]propan-2-amine;yttrium

N-[1-(methanidylideneamino)ethenyl]propan-2-amine;yttrium (PubChem CID 59037952) has the molecular formula C6H10N2Y-2 and a molecular weight of 199.07 g/mol. Its IUPAC name is N-[1-(methanidylideneamino)ethenyl]propan-2-amine;yttrium.

Molecular Properties

Compound NameN-[1-(methanidylideneamino)ethenyl]propan-2-amine;yttrium
PubChem CID59037952
Molecular FormulaC6H10N2Y-2
Molecular Weight199.07 g/mol
Exact Mass198.99
IUPAC NameN-[1-(methanidylideneamino)ethenyl]propan-2-amine;yttrium
SMILES[H]/[C-]=N/C(=[C-]/[H])NC(C)C.[Y]
InChIInChI=1S/C6H10N2.Y/c1-5(2)8-6(3)7-4;/h3-5,8H,1-2H3;/q-2;
InChIKeyHETZHTFFSKJFEJ-UHFFFAOYSA-N
XLogP0.83
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.07
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2-methyl-1,3-di(propan-2-yl)guanidine
CID 21364757
1,2,3-tri(propan-2-yl)guanidine
CID 547015
N,N'-di(propan-2-yl)ethanedithioamide
CID 3032814
N,N'-di(propan-2-yl)ethanimidamide
CID 11205611
tris(N,N'-di(propan-2-yl)ethanimidamide);ruthenium
CID 158470992
propan-2-amine;propan-2-ylcarbamodithioic acid
CID 5355267
(3Z)-2-methylpenta-1,3-diene;yttrium
CID 58172805
cobalt(2+);bis(N,N'-di(propan-2-yl)ethanimidamide)
CID 172756363
N-(3,3-dimethylbut-1-en-2-yl)-2-methylpropan-1-imine;yttrium
CID 155657078
ethane;N-prop-1-en-2-ylpropan-2-amine
CID 143917378
propan-2-ylcarbamothioic S-acid
CID 13025506
(3E)-N-propan-2-ylpenta-1,3-dien-2-amine
CID 126549325

Frequently Asked Questions

What is the IUPAC name of N-[1-(methanidylideneamino)ethenyl]propan-2-amine;yttrium?
The IUPAC name of N-[1-(methanidylideneamino)ethenyl]propan-2-amine;yttrium (CID 59037952) is N-[1-(methanidylideneamino)ethenyl]propan-2-amine;yttrium.
What is the SMILES notation for N-[1-(methanidylideneamino)ethenyl]propan-2-amine;yttrium?
The canonical SMILES for N-[1-(methanidylideneamino)ethenyl]propan-2-amine;yttrium is [H]/[C-]=N/C(=[C-]/[H])NC(C)C.[Y].
What is the InChIKey of N-[1-(methanidylideneamino)ethenyl]propan-2-amine;yttrium?
The InChIKey is HETZHTFFSKJFEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2.Y/c1-5(2)8-6(3)7-4;/h3-5,8H,1-2H3;/q-2;.
What are the key properties of N-[1-(methanidylideneamino)ethenyl]propan-2-amine;yttrium?
N-[1-(methanidylideneamino)ethenyl]propan-2-amine;yttrium has a molecular weight of 199.07 g/mol, XLogP of 0.83, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(methanidylideneamino)ethenyl]propan-2-amine;yttrium is sourced from PubChem (CID 59037952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).