2-[butyl(formyl)amino]ethylmercury

C7H14HgNO — CID 142121724

IUPAC2-[butyl(formyl)amino]ethylmercury
SMILESCCCCN(C=O)CC[Hg]
InChIInChI=1S/C7H14NO.Hg/c1-3-5-6-8(4-2)7-9;/h7H,2-6H2,1H3;
InChIKeyDWLMYCHCCMVXNA-UHFFFAOYSA-N
MW328.79 g/mol
LogP1.21
Rot. Bonds6

About 2-[butyl(formyl)amino]ethylmercury

2-[butyl(formyl)amino]ethylmercury (PubChem CID 142121724) has the molecular formula C7H14HgNO and a molecular weight of 328.79 g/mol. Its IUPAC name is 2-[butyl(formyl)amino]ethylmercury.

Molecular Properties

Compound Name2-[butyl(formyl)amino]ethylmercury
PubChem CID142121724
Molecular FormulaC7H14HgNO
Molecular Weight328.79 g/mol
Exact Mass330.08
IUPAC Name2-[butyl(formyl)amino]ethylmercury
SMILESCCCCN(C=O)CC[Hg]
InChIInChI=1S/C7H14NO.Hg/c1-3-5-6-8(4-2)7-9;/h7H,2-6H2,1H3;
InChIKeyDWLMYCHCCMVXNA-UHFFFAOYSA-N
XLogP1.21
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms10
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.79
LogP ≤ 51.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[butyl(formyl)amino]ethylmercury?
The IUPAC name of 2-[butyl(formyl)amino]ethylmercury (CID 142121724) is 2-[butyl(formyl)amino]ethylmercury.
What is the SMILES notation for 2-[butyl(formyl)amino]ethylmercury?
The canonical SMILES for 2-[butyl(formyl)amino]ethylmercury is CCCCN(C=O)CC[Hg].
What is the InChIKey of 2-[butyl(formyl)amino]ethylmercury?
The InChIKey is DWLMYCHCCMVXNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14NO.Hg/c1-3-5-6-8(4-2)7-9;/h7H,2-6H2,1H3;.
What are the key properties of 2-[butyl(formyl)amino]ethylmercury?
2-[butyl(formyl)amino]ethylmercury has a molecular weight of 328.79 g/mol, XLogP of 1.21, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[butyl(formyl)amino]ethylmercury is sourced from PubChem (CID 142121724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).