N-tert-butyl-N',N'-dimethylethane-1,2-diamine

C8H20N2 — CID 20626716

IUPACN-tert-butyl-N',N'-dimethylethane-1,2-diamine
SMILESCN(C)CCNC(C)(C)C
InChIInChI=1S/C8H20N2/c1-8(2,3)9-6-7-10(4)5/h9H,6-7H2,1-5H3
InChIKeyXGPPSKSOIFNAMM-UHFFFAOYSA-N
MW144.26 g/mol
LogP0.94
Rot. Bonds3

About N-tert-butyl-N',N'-dimethylethane-1,2-diamine

N-tert-butyl-N',N'-dimethylethane-1,2-diamine (PubChem CID 20626716) has the molecular formula C8H20N2 and a molecular weight of 144.26 g/mol. Its IUPAC name is N-tert-butyl-N',N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN-tert-butyl-N',N'-dimethylethane-1,2-diamine
PubChem CID20626716
Molecular FormulaC8H20N2
Molecular Weight144.26 g/mol
Exact Mass144.16
IUPAC NameN-tert-butyl-N',N'-dimethylethane-1,2-diamine
SMILESCN(C)CCNC(C)(C)C
InChIInChI=1S/C8H20N2/c1-8(2,3)9-6-7-10(4)5/h9H,6-7H2,1-5H3
InChIKeyXGPPSKSOIFNAMM-UHFFFAOYSA-N
XLogP0.94
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.26
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-N',N'-dimethylethane-1,2-diamine?
The IUPAC name of N-tert-butyl-N',N'-dimethylethane-1,2-diamine (CID 20626716) is N-tert-butyl-N',N'-dimethylethane-1,2-diamine.
What is the SMILES notation for N-tert-butyl-N',N'-dimethylethane-1,2-diamine?
The canonical SMILES for N-tert-butyl-N',N'-dimethylethane-1,2-diamine is CN(C)CCNC(C)(C)C.
What is the InChIKey of N-tert-butyl-N',N'-dimethylethane-1,2-diamine?
The InChIKey is XGPPSKSOIFNAMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2/c1-8(2,3)9-6-7-10(4)5/h9H,6-7H2,1-5H3.
What are the key properties of N-tert-butyl-N',N'-dimethylethane-1,2-diamine?
N-tert-butyl-N',N'-dimethylethane-1,2-diamine has a molecular weight of 144.26 g/mol, XLogP of 0.94, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-N',N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 20626716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).