bis(ethene-1,1,2,2-tetramine);hydrochloride

C4H17ClN8 — CID 118112492

IUPACbis(ethene-1,1,2,2-tetramine);hydrochloride
SMILESCl.NC(N)=C(N)N.NC(N)=C(N)N
InChIInChI=1S/2C2H8N4.ClH/c2*3-1(4)2(5)6;/h2*3-6H2;1H
InChIKeyVPRNUUOJMXADCH-UHFFFAOYSA-N
MW212.69 g/mol
LogP-3.68
Rot. Bonds

About bis(ethene-1,1,2,2-tetramine);hydrochloride

bis(ethene-1,1,2,2-tetramine);hydrochloride (PubChem CID 118112492) has the molecular formula C4H17ClN8 and a molecular weight of 212.69 g/mol. Its IUPAC name is bis(ethene-1,1,2,2-tetramine);hydrochloride.

Molecular Properties

Compound Namebis(ethene-1,1,2,2-tetramine);hydrochloride
PubChem CID118112492
Molecular FormulaC4H17ClN8
Molecular Weight212.69 g/mol
Exact Mass212.13
IUPAC Namebis(ethene-1,1,2,2-tetramine);hydrochloride
SMILESCl.NC(N)=C(N)N.NC(N)=C(N)N
InChIInChI=1S/2C2H8N4.ClH/c2*3-1(4)2(5)6;/h2*3-6H2;1H
InChIKeyVPRNUUOJMXADCH-UHFFFAOYSA-N
XLogP-3.68
TPSA208.16 Ų
H-Bond Donors8
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500212.69
LogP ≤ 5-3.68
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of bis(ethene-1,1,2,2-tetramine);hydrochloride?
The IUPAC name of bis(ethene-1,1,2,2-tetramine);hydrochloride (CID 118112492) is bis(ethene-1,1,2,2-tetramine);hydrochloride.
What is the SMILES notation for bis(ethene-1,1,2,2-tetramine);hydrochloride?
The canonical SMILES for bis(ethene-1,1,2,2-tetramine);hydrochloride is Cl.NC(N)=C(N)N.NC(N)=C(N)N.
What is the InChIKey of bis(ethene-1,1,2,2-tetramine);hydrochloride?
The InChIKey is VPRNUUOJMXADCH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C2H8N4.ClH/c2*3-1(4)2(5)6;/h2*3-6H2;1H.
What are the key properties of bis(ethene-1,1,2,2-tetramine);hydrochloride?
bis(ethene-1,1,2,2-tetramine);hydrochloride has a molecular weight of 212.69 g/mol, XLogP of -3.68, 0 rotatable bonds, 8 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for bis(ethene-1,1,2,2-tetramine);hydrochloride is sourced from PubChem (CID 118112492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).