N-(ethenyliminomethyl)propan-2-amine;yttrium

C6H10N2Y-2 — CID 59037963

IUPACN-(ethenyliminomethyl)propan-2-amine;yttrium
SMILES[H]/[C-]=C/N=[C-]/NC(C)C.[Y]
InChIInChI=1S/C6H10N2.Y/c1-4-7-5-8-6(2)3;/h1,4,6H,2-3H3,(H,7,8);/q-2;
InChIKeyFVYDKQCLGVVZKZ-UHFFFAOYSA-N
MW199.07 g/mol
LogP0.83
Rot. Bonds3

About N-(ethenyliminomethyl)propan-2-amine;yttrium

N-(ethenyliminomethyl)propan-2-amine;yttrium (PubChem CID 59037963) has the molecular formula C6H10N2Y-2 and a molecular weight of 199.07 g/mol. Its IUPAC name is N-(ethenyliminomethyl)propan-2-amine;yttrium.

Molecular Properties

Compound NameN-(ethenyliminomethyl)propan-2-amine;yttrium
PubChem CID59037963
Molecular FormulaC6H10N2Y-2
Molecular Weight199.07 g/mol
Exact Mass198.99
IUPAC NameN-(ethenyliminomethyl)propan-2-amine;yttrium
SMILES[H]/[C-]=C/N=[C-]/NC(C)C.[Y]
InChIInChI=1S/C6H10N2.Y/c1-4-7-5-8-6(2)3;/h1,4,6H,2-3H3,(H,7,8);/q-2;
InChIKeyFVYDKQCLGVVZKZ-UHFFFAOYSA-N
XLogP0.83
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
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 ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'enamine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N-ethenyl-N'-propan-2-ylcarbamimidoyl fluoride
CID 146392697
1-tert-butyl-1H-imidazol-1-ium
CID 17835947
3-methyl-1-propyl-1H-imidazole-1,3-diium
CID 22088709
1-propan-2-yl-1H-imidazol-1-ium
CID 22597213
1-ethyl-1H-imidazol-1-ium
CID 23288726
N-ethenyl-N'-propan-2-ylmethanimidamide
CID 23558871
1-propan-2-yl-1H-imidazol-1-ium bromide
CID 70487448
N-ethenyl-N'-propan-2-ylethanimidamide
CID 123229042
N-ethenyl-N'-(propan-2-yliminomethyl)methanimidamide
CID 137509596
N'-butan-2-yl-N-ethenylmethanimidamide
CID 139354464
1-Ethenyl-2-propan-2-ylguanidine
CID 147357883
N'-(3-aminobutyl)-N-ethenylmethanimidamide
CID 156184246

Frequently Asked Questions

What is the IUPAC name of N-(ethenyliminomethyl)propan-2-amine;yttrium?
The IUPAC name of N-(ethenyliminomethyl)propan-2-amine;yttrium (CID 59037963) is N-(ethenyliminomethyl)propan-2-amine;yttrium.
What is the SMILES notation for N-(ethenyliminomethyl)propan-2-amine;yttrium?
The canonical SMILES for N-(ethenyliminomethyl)propan-2-amine;yttrium is [H]/[C-]=C/N=[C-]/NC(C)C.[Y].
What is the InChIKey of N-(ethenyliminomethyl)propan-2-amine;yttrium?
The InChIKey is FVYDKQCLGVVZKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2.Y/c1-4-7-5-8-6(2)3;/h1,4,6H,2-3H3,(H,7,8);/q-2;.
What are the key properties of N-(ethenyliminomethyl)propan-2-amine;yttrium?
N-(ethenyliminomethyl)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 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(ethenyliminomethyl)propan-2-amine;yttrium is sourced from PubChem (CID 59037963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).