2-[2-aminoethylsulfanyl(dibutyl)germyl]sulfanylethanamine

C12H30GeN2S2 — CID 16698594

IUPAC2-[2-aminoethylsulfanyl(dibutyl)germyl]sulfanylethanamine
SMILESCCCC[Ge](CCCC)(SCCN)SCCN
InChIInChI=1S/C12H30GeN2S2/c1-3-5-7-13(8-6-4-2,16-11-9-14)17-12-10-15/h3-12,14-15H2,1-2H3
InChIKeyHQVNLZAKWBNXSI-UHFFFAOYSA-N
MW339.13 g/mol
LogP3.41
Rot. Bonds12

About 2-[2-aminoethylsulfanyl(dibutyl)germyl]sulfanylethanamine

2-[2-aminoethylsulfanyl(dibutyl)germyl]sulfanylethanamine (PubChem CID 16698594) has the molecular formula C12H30GeN2S2 and a molecular weight of 339.13 g/mol. Its IUPAC name is 2-[2-aminoethylsulfanyl(dibutyl)germyl]sulfanylethanamine.

Molecular Properties

Compound Name2-[2-aminoethylsulfanyl(dibutyl)germyl]sulfanylethanamine
PubChem CID16698594
Molecular FormulaC12H30GeN2S2
Molecular Weight339.13 g/mol
Exact Mass340.11
IUPAC Name2-[2-aminoethylsulfanyl(dibutyl)germyl]sulfanylethanamine
SMILESCCCC[Ge](CCCC)(SCCN)SCCN
InChIInChI=1S/C12H30GeN2S2/c1-3-5-7-13(8-6-4-2,16-11-9-14)17-12-10-15/h3-12,14-15H2,1-2H3
InChIKeyHQVNLZAKWBNXSI-UHFFFAOYSA-N
XLogP3.41
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds12
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.13
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[2-aminoethylsulfanyl(dibutyl)germyl]sulfanylethanamine?
The IUPAC name of 2-[2-aminoethylsulfanyl(dibutyl)germyl]sulfanylethanamine (CID 16698594) is 2-[2-aminoethylsulfanyl(dibutyl)germyl]sulfanylethanamine.
What is the SMILES notation for 2-[2-aminoethylsulfanyl(dibutyl)germyl]sulfanylethanamine?
The canonical SMILES for 2-[2-aminoethylsulfanyl(dibutyl)germyl]sulfanylethanamine is CCCC[Ge](CCCC)(SCCN)SCCN.
What is the InChIKey of 2-[2-aminoethylsulfanyl(dibutyl)germyl]sulfanylethanamine?
The InChIKey is HQVNLZAKWBNXSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H30GeN2S2/c1-3-5-7-13(8-6-4-2,16-11-9-14)17-12-10-15/h3-12,14-15H2,1-2H3.
What are the key properties of 2-[2-aminoethylsulfanyl(dibutyl)germyl]sulfanylethanamine?
2-[2-aminoethylsulfanyl(dibutyl)germyl]sulfanylethanamine has a molecular weight of 339.13 g/mol, XLogP of 3.41, 12 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-aminoethylsulfanyl(dibutyl)germyl]sulfanylethanamine is sourced from PubChem (CID 16698594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).