N,N-dimethyl-1-propyliminomethanamine;yttrium

C6H12N2Y-2 — CID 59952991

IUPACN,N-dimethyl-1-propyliminomethanamine;yttrium
SMILES[CH2-]CC/N=[C-]/N(C)C.[Y]
InChIInChI=1S/C6H12N2.Y/c1-4-5-7-6-8(2)3;/h1,4-5H2,2-3H3;/q-2;
InChIKeyLYPORDIYWSPESQ-UHFFFAOYSA-N
MW201.08 g/mol
LogP0.67
Rot. Bonds3

About N,N-dimethyl-1-propyliminomethanamine;yttrium

N,N-dimethyl-1-propyliminomethanamine;yttrium (PubChem CID 59952991) has the molecular formula C6H12N2Y-2 and a molecular weight of 201.08 g/mol. Its IUPAC name is N,N-dimethyl-1-propyliminomethanamine;yttrium.

Molecular Properties

Compound NameN,N-dimethyl-1-propyliminomethanamine;yttrium
PubChem CID59952991
Molecular FormulaC6H12N2Y-2
Molecular Weight201.08 g/mol
Exact Mass201.01
IUPAC NameN,N-dimethyl-1-propyliminomethanamine;yttrium
SMILES[CH2-]CC/N=[C-]/N(C)C.[Y]
InChIInChI=1S/C6H12N2.Y/c1-4-5-7-6-8(2)3;/h1,4-5H2,2-3H3;/q-2;
InChIKeyLYPORDIYWSPESQ-UHFFFAOYSA-N
XLogP0.67
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.08
LogP ≤ 50.67
H-Bond Donors ≤ 50
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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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-propyliminomethanamine;yttrium?
The IUPAC name of N,N-dimethyl-1-propyliminomethanamine;yttrium (CID 59952991) is N,N-dimethyl-1-propyliminomethanamine;yttrium.
What is the SMILES notation for N,N-dimethyl-1-propyliminomethanamine;yttrium?
The canonical SMILES for N,N-dimethyl-1-propyliminomethanamine;yttrium is [CH2-]CC/N=[C-]/N(C)C.[Y].
What is the InChIKey of N,N-dimethyl-1-propyliminomethanamine;yttrium?
The InChIKey is LYPORDIYWSPESQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2.Y/c1-4-5-7-6-8(2)3;/h1,4-5H2,2-3H3;/q-2;.
What are the key properties of N,N-dimethyl-1-propyliminomethanamine;yttrium?
N,N-dimethyl-1-propyliminomethanamine;yttrium has a molecular weight of 201.08 g/mol, XLogP of 0.67, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-propyliminomethanamine;yttrium is sourced from PubChem (CID 59952991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).