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

C6H18N2 — CID 90689080

IUPACN,N'-dimethylethane-1,2-diamine;ethane
SMILESCC.CNCCNC
InChIInChI=1S/C4H12N2.C2H6/c1-5-3-4-6-2;1-2/h5-6H,3-4H2,1-2H3;1-2H3
InChIKeyGVRLQCGTYNIJSZ-UHFFFAOYSA-N
MW118.22 g/mol
LogP0.45
Rot. Bonds3

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

N,N'-dimethylethane-1,2-diamine;ethane (PubChem CID 90689080) has the molecular formula C6H18N2 and a molecular weight of 118.22 g/mol. Its IUPAC name is N,N'-dimethylethane-1,2-diamine;ethane.

Molecular Properties

Compound NameN,N'-dimethylethane-1,2-diamine;ethane
PubChem CID90689080
Molecular FormulaC6H18N2
Molecular Weight118.22 g/mol
Exact Mass118.15
IUPAC NameN,N'-dimethylethane-1,2-diamine;ethane
SMILESCC.CNCCNC
InChIInChI=1S/C4H12N2.C2H6/c1-5-3-4-6-2;1-2/h5-6H,3-4H2,1-2H3;1-2H3
InChIKeyGVRLQCGTYNIJSZ-UHFFFAOYSA-N
XLogP0.45
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.22
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethane;N-[2-(methylamino)ethyl]thiohydroxylamine
CID 153374954
N-methylmethanamine;N-methyl-N'-[2-(methylamino)ethyl]ethane-1,2-diamine
CID 143227011
N,N'-dimethylheptane-1,7-diamine;ethane;molecular hydrogen
CID 176578398
N'-[2-[bis[2-(methylamino)ethyl]amino]ethyl]-N-methylethane-1,2-diamine
CID 20736880
ethane;2-[2-(methylamino)ethylamino]acetaldehyde
CID 144858841
ethane;2-methoxy-N-methylethanamine
CID 91504059
[2-(methylamino)ethylamino]methanol
CID 58963756
ethane;N-methylbutan-1-amine;propane
CID 142092371
N,N'-dimethylhexane-1,6-diamine;hydrochloride
CID 154634683
CID 59941554
CID 59941554
N',N'-diethyl-N-methylethane-1,2-diamine;ethane
CID 142004273
N'-hydroxysulfanyl-N-methylethane-1,2-diamine
CID 89126614

Frequently Asked Questions

What is the IUPAC name of N,N'-dimethylethane-1,2-diamine;ethane?
The IUPAC name of N,N'-dimethylethane-1,2-diamine;ethane (CID 90689080) is N,N'-dimethylethane-1,2-diamine;ethane.
What is the SMILES notation for N,N'-dimethylethane-1,2-diamine;ethane?
The canonical SMILES for N,N'-dimethylethane-1,2-diamine;ethane is CC.CNCCNC.
What is the InChIKey of N,N'-dimethylethane-1,2-diamine;ethane?
The InChIKey is GVRLQCGTYNIJSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N2.C2H6/c1-5-3-4-6-2;1-2/h5-6H,3-4H2,1-2H3;1-2H3.
What are the key properties of N,N'-dimethylethane-1,2-diamine;ethane?
N,N'-dimethylethane-1,2-diamine;ethane has a molecular weight of 118.22 g/mol, XLogP of 0.45, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dimethylethane-1,2-diamine;ethane is sourced from PubChem (CID 90689080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).