2-N,2-N-dimethylbutane-1,2-diamine;dihydrochloride

C6H18Cl2N2 — CID 43810640

IUPAC2-N,2-N-dimethylbutane-1,2-diamine;dihydrochloride
SMILESCCC(CN)N(C)C.Cl.Cl
InChIInChI=1S/C6H16N2.2ClH/c1-4-6(5-7)8(2)3;;/h6H,4-5,7H2,1-3H3;2*1H
InChIKeyIMWJTZUGIAWJMX-UHFFFAOYSA-N
MW189.13 g/mol
LogP1.13
Rot. Bonds3

About 2-N,2-N-dimethylbutane-1,2-diamine;dihydrochloride

2-N,2-N-dimethylbutane-1,2-diamine;dihydrochloride (PubChem CID 43810640) has the molecular formula C6H18Cl2N2 and a molecular weight of 189.13 g/mol. Its IUPAC name is 2-N,2-N-dimethylbutane-1,2-diamine;dihydrochloride.

Molecular Properties

Compound Name2-N,2-N-dimethylbutane-1,2-diamine;dihydrochloride
PubChem CID43810640
Molecular FormulaC6H18Cl2N2
Molecular Weight189.13 g/mol
Exact Mass188.08
IUPAC Name2-N,2-N-dimethylbutane-1,2-diamine;dihydrochloride
SMILESCCC(CN)N(C)C.Cl.Cl
InChIInChI=1S/C6H16N2.2ClH/c1-4-6(5-7)8(2)3;;/h6H,4-5,7H2,1-3H3;2*1H
InChIKeyIMWJTZUGIAWJMX-UHFFFAOYSA-N
XLogP1.13
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.13
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-N,2-N-dimethylbutane-1,2,4-triamine
CID 18471403
2-N-hexan-3-yl-2-N-methylbutane-1,2-diamine
CID 155282396
1-amino-2-[methyl(sulfamoyl)amino]butane
CID 131223214
1-(1-aminobutan-2-yl)-1-methylurea
CID 82502509
2-N,2-N,4,4-tetramethylpentane-1,2-diamine
CID 62950039
N'-methyl-N'-pentan-3-ylmethanediamine
CID 58780835
1-[2-(dimethylamino)butyldisulfanyl]-N,N-dimethylbutan-2-amine
CID 139604826
4-amino-3-(dimethylamino)butanamide
CID 66427747
1-chloro-N,N-dimethylpentan-3-amine
CID 116907512
N,N-dimethylheptan-4-amine;hydrochloride
CID 138400485
N-(1-aminobutan-2-yl)-N-methylprop-2-ynamide
CID 82502636
2-N-(cyclopentylmethyl)-2-N-methylbutane-1,2-diamine
CID 63632440

Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-dimethylbutane-1,2-diamine;dihydrochloride?
The IUPAC name of 2-N,2-N-dimethylbutane-1,2-diamine;dihydrochloride (CID 43810640) is 2-N,2-N-dimethylbutane-1,2-diamine;dihydrochloride.
What is the SMILES notation for 2-N,2-N-dimethylbutane-1,2-diamine;dihydrochloride?
The canonical SMILES for 2-N,2-N-dimethylbutane-1,2-diamine;dihydrochloride is CCC(CN)N(C)C.Cl.Cl.
What is the InChIKey of 2-N,2-N-dimethylbutane-1,2-diamine;dihydrochloride?
The InChIKey is IMWJTZUGIAWJMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N2.2ClH/c1-4-6(5-7)8(2)3;;/h6H,4-5,7H2,1-3H3;2*1H.
What are the key properties of 2-N,2-N-dimethylbutane-1,2-diamine;dihydrochloride?
2-N,2-N-dimethylbutane-1,2-diamine;dihydrochloride has a molecular weight of 189.13 g/mol, XLogP of 1.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-dimethylbutane-1,2-diamine;dihydrochloride is sourced from PubChem (CID 43810640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).