N',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride

C8H22Cl2N2O2 — CID 86811567

IUPACN',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride
SMILESCOCCN(CCN)CCOC.Cl.Cl
InChIInChI=1S/C8H20N2O2.2ClH/c1-11-7-5-10(4-3-9)6-8-12-2;;/h3-9H2,1-2H3;2*1H
InChIKeyQFTVLXQUKHCPJP-UHFFFAOYSA-N
MW249.18 g/mol
LogP0.38
Rot. Bonds8

About N',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride

N',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride (PubChem CID 86811567) has the molecular formula C8H22Cl2N2O2 and a molecular weight of 249.18 g/mol. Its IUPAC name is N',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride.

Molecular Properties

Compound NameN',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride
PubChem CID86811567
Molecular FormulaC8H22Cl2N2O2
Molecular Weight249.18 g/mol
Exact Mass248.11
IUPAC NameN',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride
SMILESCOCCN(CCN)CCOC.Cl.Cl
InChIInChI=1S/C8H20N2O2.2ClH/c1-11-7-5-10(4-3-9)6-8-12-2;;/h3-9H2,1-2H3;2*1H
InChIKeyQFTVLXQUKHCPJP-UHFFFAOYSA-N
XLogP0.38
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.18
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride?
The IUPAC name of N',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride (CID 86811567) is N',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride.
What is the SMILES notation for N',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride?
The canonical SMILES for N',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride is COCCN(CCN)CCOC.Cl.Cl.
What is the InChIKey of N',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride?
The InChIKey is QFTVLXQUKHCPJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O2.2ClH/c1-11-7-5-10(4-3-9)6-8-12-2;;/h3-9H2,1-2H3;2*1H.
What are the key properties of N',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride?
N',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride has a molecular weight of 249.18 g/mol, XLogP of 0.38, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-bis(2-methoxyethyl)ethane-1,2-diamine;dihydrochloride is sourced from PubChem (CID 86811567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).