3-N-tert-butyl-3-N,4-N-dimethyloxane-3,4-diamine

C11H24N2O — CID 130834147

IUPAC3-N-tert-butyl-3-N,4-N-dimethyloxane-3,4-diamine
SMILESCNC1CCOCC1N(C)C(C)(C)C
InChIInChI=1S/C11H24N2O/c1-11(2,3)13(5)10-8-14-7-6-9(10)12-4/h9-10,12H,6-8H2,1-5H3
InChIKeyZIUWUEWFBMCGSL-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.09
Rot. Bonds2

About 3-N-tert-butyl-3-N,4-N-dimethyloxane-3,4-diamine

3-N-tert-butyl-3-N,4-N-dimethyloxane-3,4-diamine (PubChem CID 130834147) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 3-N-tert-butyl-3-N,4-N-dimethyloxane-3,4-diamine.

Molecular Properties

Compound Name3-N-tert-butyl-3-N,4-N-dimethyloxane-3,4-diamine
PubChem CID130834147
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name3-N-tert-butyl-3-N,4-N-dimethyloxane-3,4-diamine
SMILESCNC1CCOCC1N(C)C(C)(C)C
InChIInChI=1S/C11H24N2O/c1-11(2,3)13(5)10-8-14-7-6-9(10)12-4/h9-10,12H,6-8H2,1-5H3
InChIKeyZIUWUEWFBMCGSL-UHFFFAOYSA-N
XLogP1.09
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-N-methyl-3-N-(2-methylpropyl)-3-N-pentan-3-yloxane-3,4-diamine
CID 79484117
(3S,4R)-4-(methylamino)oxan-3-ol
CID 68677504
3-N-cyclopropyl-4-N-methyl-3-N-(3-methylbutyl)oxane-3,4-diamine
CID 78976656
N-methyl-3-[[methyl(3-methylbutan-2-yl)amino]methyl]oxan-4-amine
CID 103058880
1-[methyl-[[4-(methylamino)oxan-3-yl]methyl]amino]propan-2-ol
CID 103059860
3-(methylamino)oxan-4-ol
CID 55287171
N-methyl-3-(2-methylpropyl)oxan-4-amine
CID 106469078
N,N-dimethyl-5-[4-(methylamino)oxan-3-yl]-1,2,4-oxadiazol-3-amine
CID 106474742
3-N-[1-(2-methoxyphenyl)propan-2-yl]-3-N,4-N-dimethyloxane-3,4-diamine
CID 65488358
1-N,4-N-dimethyl-4-N-(3-methyloxan-4-yl)cyclohexane-1,4-diamine
CID 114240632
3-(3-methoxypropyl)-N-methyloxan-4-amine
CID 106469107
4-N-tert-butyl-1-N,4-N-dimethylcyclohexane-1,4-diamine
CID 117029205

Frequently Asked Questions

What is the IUPAC name of 3-N-tert-butyl-3-N,4-N-dimethyloxane-3,4-diamine?
The IUPAC name of 3-N-tert-butyl-3-N,4-N-dimethyloxane-3,4-diamine (CID 130834147) is 3-N-tert-butyl-3-N,4-N-dimethyloxane-3,4-diamine.
What is the SMILES notation for 3-N-tert-butyl-3-N,4-N-dimethyloxane-3,4-diamine?
The canonical SMILES for 3-N-tert-butyl-3-N,4-N-dimethyloxane-3,4-diamine is CNC1CCOCC1N(C)C(C)(C)C.
What is the InChIKey of 3-N-tert-butyl-3-N,4-N-dimethyloxane-3,4-diamine?
The InChIKey is ZIUWUEWFBMCGSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-11(2,3)13(5)10-8-14-7-6-9(10)12-4/h9-10,12H,6-8H2,1-5H3.
What are the key properties of 3-N-tert-butyl-3-N,4-N-dimethyloxane-3,4-diamine?
3-N-tert-butyl-3-N,4-N-dimethyloxane-3,4-diamine has a molecular weight of 200.33 g/mol, XLogP of 1.09, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-N-tert-butyl-3-N,4-N-dimethyloxane-3,4-diamine is sourced from PubChem (CID 130834147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).