1-(ethylideneamino)-N-methylmethanamine;rhenium

C4H9N2Re- — CID 163852530

IUPAC1-(ethylideneamino)-N-methylmethanamine;rhenium
SMILES[CH2-]C=NCNC.[Re]
InChIInChI=1S/C4H9N2.Re/c1-3-6-4-5-2;/h3,5H,1,4H2,2H3;/q-1;
InChIKeyLWGDQKMBMRYCOJ-UHFFFAOYSA-N
MW271.34 g/mol
LogP0.07
Rot. Bonds2

About 1-(ethylideneamino)-N-methylmethanamine;rhenium

1-(ethylideneamino)-N-methylmethanamine;rhenium (PubChem CID 163852530) has the molecular formula C4H9N2Re- and a molecular weight of 271.34 g/mol. Its IUPAC name is 1-(ethylideneamino)-N-methylmethanamine;rhenium.

Molecular Properties

Compound Name1-(ethylideneamino)-N-methylmethanamine;rhenium
PubChem CID163852530
Molecular FormulaC4H9N2Re-
Molecular Weight271.34 g/mol
Exact Mass272.03
IUPAC Name1-(ethylideneamino)-N-methylmethanamine;rhenium
SMILES[CH2-]C=NCNC.[Re]
InChIInChI=1S/C4H9N2.Re/c1-3-6-4-5-2;/h3,5H,1,4H2,2H3;/q-1;
InChIKeyLWGDQKMBMRYCOJ-UHFFFAOYSA-N
XLogP0.07
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 50.07
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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Frequently Asked Questions

What is the IUPAC name of 1-(ethylideneamino)-N-methylmethanamine;rhenium?
The IUPAC name of 1-(ethylideneamino)-N-methylmethanamine;rhenium (CID 163852530) is 1-(ethylideneamino)-N-methylmethanamine;rhenium.
What is the SMILES notation for 1-(ethylideneamino)-N-methylmethanamine;rhenium?
The canonical SMILES for 1-(ethylideneamino)-N-methylmethanamine;rhenium is [CH2-]C=NCNC.[Re].
What is the InChIKey of 1-(ethylideneamino)-N-methylmethanamine;rhenium?
The InChIKey is LWGDQKMBMRYCOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9N2.Re/c1-3-6-4-5-2;/h3,5H,1,4H2,2H3;/q-1;.
What are the key properties of 1-(ethylideneamino)-N-methylmethanamine;rhenium?
1-(ethylideneamino)-N-methylmethanamine;rhenium has a molecular weight of 271.34 g/mol, XLogP of 0.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylideneamino)-N-methylmethanamine;rhenium is sourced from PubChem (CID 163852530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).