1-N-ethyl-1-N,2-N,2-trimethylpropane-1,2-diamine

C8H20N2 — CID 62848035

IUPAC1-N-ethyl-1-N,2-N,2-trimethylpropane-1,2-diamine
SMILESCCN(C)CC(C)(C)NC
InChIInChI=1S/C8H20N2/c1-6-10(5)7-8(2,3)9-4/h9H,6-7H2,1-5H3
InChIKeyJADORDOHXPPNJG-UHFFFAOYSA-N
MW144.26 g/mol
LogP0.94
Rot. Bonds4

About 1-N-ethyl-1-N,2-N,2-trimethylpropane-1,2-diamine

1-N-ethyl-1-N,2-N,2-trimethylpropane-1,2-diamine (PubChem CID 62848035) has the molecular formula C8H20N2 and a molecular weight of 144.26 g/mol. Its IUPAC name is 1-N-ethyl-1-N,2-N,2-trimethylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N-ethyl-1-N,2-N,2-trimethylpropane-1,2-diamine
PubChem CID62848035
Molecular FormulaC8H20N2
Molecular Weight144.26 g/mol
Exact Mass144.16
IUPAC Name1-N-ethyl-1-N,2-N,2-trimethylpropane-1,2-diamine
SMILESCCN(C)CC(C)(C)NC
InChIInChI=1S/C8H20N2/c1-6-10(5)7-8(2,3)9-4/h9H,6-7H2,1-5H3
InChIKeyJADORDOHXPPNJG-UHFFFAOYSA-N
XLogP0.94
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
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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Related Compounds

N,N'-Di-tert-butylethylenediamine
CID 77680
1,7-DI-(Sec.-butyl)-diethylenetriamine
CID 292506
N,N'-Dipropylethylenediamine
CID 469899
2-Amino-1,1-dimethylethylisopropylamine
CID 79532
N,N,N'-Triisopropylethylenediamine
CID 66797
(2-Aminoethyl)(tert-butyl)amine
CID 12504477
1,2,2-Trimethylpiperazine
CID 21973776
N1,N1-Diethyl-N2-propyl-1,2-ethanediamine
CID 295969
1,2-Ethanediamine, N,N'-bis(1-methylpropyl)-
CID 469901
N,N'-Di-t-butyl-trimethylenediamine
CID 469925
1,2,2,6,6-Pentamethylpiperazine
CID 114362
1,2-Propanediamine, N(sup 2)-butyl-2-methyl-
CID 3039391

Frequently Asked Questions

What is the IUPAC name of 1-N-ethyl-1-N,2-N,2-trimethylpropane-1,2-diamine?
The IUPAC name of 1-N-ethyl-1-N,2-N,2-trimethylpropane-1,2-diamine (CID 62848035) is 1-N-ethyl-1-N,2-N,2-trimethylpropane-1,2-diamine.
What is the SMILES notation for 1-N-ethyl-1-N,2-N,2-trimethylpropane-1,2-diamine?
The canonical SMILES for 1-N-ethyl-1-N,2-N,2-trimethylpropane-1,2-diamine is CCN(C)CC(C)(C)NC.
What is the InChIKey of 1-N-ethyl-1-N,2-N,2-trimethylpropane-1,2-diamine?
The InChIKey is JADORDOHXPPNJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2/c1-6-10(5)7-8(2,3)9-4/h9H,6-7H2,1-5H3.
What are the key properties of 1-N-ethyl-1-N,2-N,2-trimethylpropane-1,2-diamine?
1-N-ethyl-1-N,2-N,2-trimethylpropane-1,2-diamine has a molecular weight of 144.26 g/mol, XLogP of 0.94, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-ethyl-1-N,2-N,2-trimethylpropane-1,2-diamine is sourced from PubChem (CID 62848035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).