N',N'-dimethylethane-1,2-diamine;dihydrochloride

C4H14Cl2N2 — CID 517631

IUPACN',N'-dimethylethane-1,2-diamine;dihydrochloride
SMILESCN(C)CCN.Cl.Cl
InChIInChI=1S/C4H12N2.2ClH/c1-6(2)4-3-5;;/h3-5H2,1-2H3;2*1H
InChIKeyPRFNLTCRRYQZOE-UHFFFAOYSA-N
MW161.08 g/mol
LogP0.35
Rot. Bonds2

About N',N'-dimethylethane-1,2-diamine;dihydrochloride

N',N'-dimethylethane-1,2-diamine;dihydrochloride (PubChem CID 517631) has the molecular formula C4H14Cl2N2 and a molecular weight of 161.08 g/mol. Its IUPAC name is N',N'-dimethylethane-1,2-diamine;dihydrochloride.

Molecular Properties

Compound NameN',N'-dimethylethane-1,2-diamine;dihydrochloride
PubChem CID517631
Molecular FormulaC4H14Cl2N2
Molecular Weight161.08 g/mol
Exact Mass160.05
IUPAC NameN',N'-dimethylethane-1,2-diamine;dihydrochloride
SMILESCN(C)CCN.Cl.Cl
InChIInChI=1S/C4H12N2.2ClH/c1-6(2)4-3-5;;/h3-5H2,1-2H3;2*1H
InChIKeyPRFNLTCRRYQZOE-UHFFFAOYSA-N
XLogP0.35
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.08
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N',N'-dimethylethane-1,2-diamine;dihydrochloride?
The IUPAC name of N',N'-dimethylethane-1,2-diamine;dihydrochloride (CID 517631) is N',N'-dimethylethane-1,2-diamine;dihydrochloride.
What is the SMILES notation for N',N'-dimethylethane-1,2-diamine;dihydrochloride?
The canonical SMILES for N',N'-dimethylethane-1,2-diamine;dihydrochloride is CN(C)CCN.Cl.Cl.
What is the InChIKey of N',N'-dimethylethane-1,2-diamine;dihydrochloride?
The InChIKey is PRFNLTCRRYQZOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N2.2ClH/c1-6(2)4-3-5;;/h3-5H2,1-2H3;2*1H.
What are the key properties of N',N'-dimethylethane-1,2-diamine;dihydrochloride?
N',N'-dimethylethane-1,2-diamine;dihydrochloride has a molecular weight of 161.08 g/mol, XLogP of 0.35, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dimethylethane-1,2-diamine;dihydrochloride is sourced from PubChem (CID 517631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).