3-(carboxymethoxy)propylazanide;rutherfordium

C5H10NO3Rf- — CID 58587208

IUPAC3-(carboxymethoxy)propylazanide;rutherfordium
SMILES[NH-]CCCOCC(=O)O.[Rf]
InChIInChI=1S/C5H10NO3.Rf/c6-2-1-3-9-4-5(7)8;/h6H,1-4H2,(H,7,8);/q-1;
InChIKeyBITHKNUDWNHABT-UHFFFAOYSA-N
MW399.14 g/mol
LogP0.53
Rot. Bonds5

About 3-(carboxymethoxy)propylazanide;rutherfordium

3-(carboxymethoxy)propylazanide;rutherfordium (PubChem CID 58587208) has the molecular formula C5H10NO3Rf- and a molecular weight of 399.14 g/mol. Its IUPAC name is 3-(carboxymethoxy)propylazanide;rutherfordium.

Molecular Properties

Compound Name3-(carboxymethoxy)propylazanide;rutherfordium
PubChem CID58587208
Molecular FormulaC5H10NO3Rf-
Molecular Weight399.14 g/mol
Exact Mass399.19
IUPAC Name3-(carboxymethoxy)propylazanide;rutherfordium
SMILES[NH-]CCCOCC(=O)O.[Rf]
InChIInChI=1S/C5H10NO3.Rf/c6-2-1-3-9-4-5(7)8;/h6H,1-4H2,(H,7,8);/q-1;
InChIKeyBITHKNUDWNHABT-UHFFFAOYSA-N
XLogP0.53
TPSA70.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.14
LogP ≤ 50.53
H-Bond Donors ≤ 51
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 3-(carboxymethoxy)propylazanide;rutherfordium?
The IUPAC name of 3-(carboxymethoxy)propylazanide;rutherfordium (CID 58587208) is 3-(carboxymethoxy)propylazanide;rutherfordium.
What is the SMILES notation for 3-(carboxymethoxy)propylazanide;rutherfordium?
The canonical SMILES for 3-(carboxymethoxy)propylazanide;rutherfordium is [NH-]CCCOCC(=O)O.[Rf].
What is the InChIKey of 3-(carboxymethoxy)propylazanide;rutherfordium?
The InChIKey is BITHKNUDWNHABT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10NO3.Rf/c6-2-1-3-9-4-5(7)8;/h6H,1-4H2,(H,7,8);/q-1;.
What are the key properties of 3-(carboxymethoxy)propylazanide;rutherfordium?
3-(carboxymethoxy)propylazanide;rutherfordium has a molecular weight of 399.14 g/mol, XLogP of 0.53, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(carboxymethoxy)propylazanide;rutherfordium is sourced from PubChem (CID 58587208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).