butane-1,4-diamine;europium

C4H12EuN2 — CID 90401592

IUPACbutane-1,4-diamine;europium
SMILESNCCCCN.[Eu]
InChIInChI=1S/C4H12N2.Eu/c5-3-1-2-4-6;/h1-6H2;
InChIKeyVCUOXKKQUNNJKU-UHFFFAOYSA-N
MW240.12 g/mol
LogP-0.32
Rot. Bonds3

About butane-1,4-diamine;europium

butane-1,4-diamine;europium (PubChem CID 90401592) has the molecular formula C4H12EuN2 and a molecular weight of 240.12 g/mol. Its IUPAC name is butane-1,4-diamine;europium.

Molecular Properties

Compound Namebutane-1,4-diamine;europium
PubChem CID90401592
Molecular FormulaC4H12EuN2
Molecular Weight240.12 g/mol
Exact Mass241.02
IUPAC Namebutane-1,4-diamine;europium
SMILESNCCCCN.[Eu]
InChIInChI=1S/C4H12N2.Eu/c5-3-1-2-4-6;/h1-6H2;
InChIKeyVCUOXKKQUNNJKU-UHFFFAOYSA-N
XLogP-0.32
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.12
LogP ≤ 5-0.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of butane-1,4-diamine;europium?
The IUPAC name of butane-1,4-diamine;europium (CID 90401592) is butane-1,4-diamine;europium.
What is the SMILES notation for butane-1,4-diamine;europium?
The canonical SMILES for butane-1,4-diamine;europium is NCCCCN.[Eu].
What is the InChIKey of butane-1,4-diamine;europium?
The InChIKey is VCUOXKKQUNNJKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N2.Eu/c5-3-1-2-4-6;/h1-6H2;.
What are the key properties of butane-1,4-diamine;europium?
butane-1,4-diamine;europium has a molecular weight of 240.12 g/mol, XLogP of -0.32, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butane-1,4-diamine;europium is sourced from PubChem (CID 90401592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).