ethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury

C9H20HgNO2 — CID 171823735

IUPACethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury
SMILESCC.CCCOCCNC(=O)C[Hg]
InChIInChI=1S/C7H14NO2.C2H6.Hg/c1-3-5-10-6-4-8-7(2)9;1-2;/h2-6H2,1H3,(H,8,9);1-2H3;
InChIKeyKYZXHFXPQKOAKJ-UHFFFAOYSA-N
MW374.85 g/mol
LogP1.52
Rot. Bonds6

About ethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury

ethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury (PubChem CID 171823735) has the molecular formula C9H20HgNO2 and a molecular weight of 374.85 g/mol. Its IUPAC name is ethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury.

Molecular Properties

Compound Nameethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury
PubChem CID171823735
Molecular FormulaC9H20HgNO2
Molecular Weight374.85 g/mol
Exact Mass376.12
IUPAC Nameethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury
SMILESCC.CCCOCCNC(=O)C[Hg]
InChIInChI=1S/C7H14NO2.C2H6.Hg/c1-3-5-10-6-4-8-7(2)9;1-2;/h2-6H2,1H3,(H,8,9);1-2H3;
InChIKeyKYZXHFXPQKOAKJ-UHFFFAOYSA-N
XLogP1.52
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.85
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-bromo-N-[2-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethyl]acetamide
CID 90995903
N-methyl-2-[2-[2-[[2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetyl]amino]ethoxy]ethoxy]acetamide
CID 89101434
N-butyl-2-[2-[2-[[2-(2-propoxyethoxy)acetyl]amino]ethoxy]ethoxy]acetamide
CID 89176591
N-[2-(2-aminoethoxy)ethyl]-2-propoxyacetamide
CID 107941598
2-(2-propoxyethoxy)-N-propylacetamide
CID 149463198
molecular hydrogen;N-(2-propoxyethyl)propanamide
CID 170639851
N-[2-(2-propoxyethoxy)ethyl]butanamide
CID 88853938
2-(2-oxopropoxy)-N-[2-(2-propoxyethoxy)ethyl]acetamide
CID 123445865
N-(2-methoxyethyl)-2-(2-propoxyethylamino)acetamide
CID 106452448
ethane;molecular hydrogen;N-[2-(2-propoxyethoxy)ethyl]pentanamide
CID 170639867
N-(2-bromoethyl)-2-propoxyacetamide
CID 107941217
ethane;3-propoxy-N-propylpropanamide
CID 163269237

Frequently Asked Questions

What is the IUPAC name of ethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury?
The IUPAC name of ethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury (CID 171823735) is ethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury.
What is the SMILES notation for ethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury?
The canonical SMILES for ethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury is CC.CCCOCCNC(=O)C[Hg].
What is the InChIKey of ethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury?
The InChIKey is KYZXHFXPQKOAKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14NO2.C2H6.Hg/c1-3-5-10-6-4-8-7(2)9;1-2;/h2-6H2,1H3,(H,8,9);1-2H3;.
What are the key properties of ethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury?
ethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury has a molecular weight of 374.85 g/mol, XLogP of 1.52, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;[2-oxo-2-(2-propoxyethylamino)ethyl]mercury is sourced from PubChem (CID 171823735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).