N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine

C9H26N4 — CID 87642302

IUPACN',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine
SMILESCN(C)CCCN.CN(C)CCN
InChIInChI=1S/C5H14N2.C4H12N2/c1-7(2)5-3-4-6;1-6(2)4-3-5/h3-6H2,1-2H3;3-5H2,1-2H3
InChIKeyTWXDRBSEQMIHJN-UHFFFAOYSA-N
MW190.33 g/mol
LogP-0.60
Rot. Bonds5

About N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine

N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine (PubChem CID 87642302) has the molecular formula C9H26N4 and a molecular weight of 190.33 g/mol. Its IUPAC name is N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine.

Molecular Properties

Compound NameN',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine
PubChem CID87642302
Molecular FormulaC9H26N4
Molecular Weight190.33 g/mol
Exact Mass190.22
IUPAC NameN',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine
SMILESCN(C)CCCN.CN(C)CCN
InChIInChI=1S/C5H14N2.C4H12N2/c1-7(2)5-3-4-6;1-6(2)4-3-5/h3-6H2,1-2H3;3-5H2,1-2H3
InChIKeyTWXDRBSEQMIHJN-UHFFFAOYSA-N
XLogP-0.60
TPSA58.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.33
LogP ≤ 5-0.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

bis(N',N'-dimethylpropane-1,3-diamine);dihydrochloride
CID 173033128
N',N'-dimethylicosane-1,20-diamine
CID 54351766
N',N'-dimethylbutane-1,4-diamine;silane
CID 162130960
N',N'-dimethylheptane-1,7-diamine
CID 3822076
N',N'-dimethylpentane-1,5-diamine
CID 3465925
N',N'-dimethylpropane-1,3-diamine;docosane
CID 174425037
N'-[2-[2-(2-aminoethylamino)ethylamino]ethyl]ethane-1,2-diamine;N'-[2-(2-aminoethylamino)ethyl]ethane-1,2-diamine;N'-(2-aminoethyl)ethane-1,2-diamine;bis(N',N'-dimethylpropane-1,3-diamine);ethane-1,2-diamine
CID 157170431
N',N'-dimethylpropane-1,3-diamine;4-methylpentan-2-amine
CID 19050558
2-amino-1-(dimethylamino)ethanol;N',N'-dimethylpropane-1,3-diamine
CID 161126374
bis(N',N'-dimethylethane-1,2-diamine);nickel(2+);diperchlorate
CID 12057472
N'-cyclopropyl-N'-[3-(dimethylamino)propyl]propane-1,3-diamine
CID 114524959
carbamodithioic acid;N',N'-dimethylethane-1,2-diamine
CID 174232024

Frequently Asked Questions

What is the IUPAC name of N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine?
The IUPAC name of N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine (CID 87642302) is N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine.
What is the SMILES notation for N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine?
The canonical SMILES for N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine is CN(C)CCCN.CN(C)CCN.
What is the InChIKey of N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine?
The InChIKey is TWXDRBSEQMIHJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2.C4H12N2/c1-7(2)5-3-4-6;1-6(2)4-3-5/h3-6H2,1-2H3;3-5H2,1-2H3.
What are the key properties of N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine?
N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine has a molecular weight of 190.33 g/mol, XLogP of -0.60, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-dimethylethane-1,2-diamine;N',N'-dimethylpropane-1,3-diamine is sourced from PubChem (CID 87642302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).