1-methoxy-N,4,5,5-tetramethylhexan-2-amine

C11H25NO — CID 105008981

IUPAC1-methoxy-N,4,5,5-tetramethylhexan-2-amine
SMILESCNC(COC)CC(C)C(C)(C)C
InChIInChI=1S/C11H25NO/c1-9(11(2,3)4)7-10(12-5)8-13-6/h9-10,12H,7-8H2,1-6H3
InChIKeyOVJNPTHZNUQSLY-UHFFFAOYSA-N
MW187.33 g/mol
LogP2.29
Rot. Bonds5

About 1-methoxy-N,4,5,5-tetramethylhexan-2-amine

1-methoxy-N,4,5,5-tetramethylhexan-2-amine (PubChem CID 105008981) has the molecular formula C11H25NO and a molecular weight of 187.33 g/mol. Its IUPAC name is 1-methoxy-N,4,5,5-tetramethylhexan-2-amine.

Molecular Properties

Compound Name1-methoxy-N,4,5,5-tetramethylhexan-2-amine
PubChem CID105008981
Molecular FormulaC11H25NO
Molecular Weight187.33 g/mol
Exact Mass187.19
IUPAC Name1-methoxy-N,4,5,5-tetramethylhexan-2-amine
SMILESCNC(COC)CC(C)C(C)(C)C
InChIInChI=1S/C11H25NO/c1-9(11(2,3)4)7-10(12-5)8-13-6/h9-10,12H,7-8H2,1-6H3
InChIKeyOVJNPTHZNUQSLY-UHFFFAOYSA-N
XLogP2.29
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-methoxy-N,4-dimethylpentan-2-amine
CID 13140129
1,3-dimethoxy-N-methylpropan-2-amine;ethane
CID 171819113
N-ethyl-1-methoxy-6,7,7-trimethyloctan-4-amine
CID 105054759
N,2,7,8,8-pentamethylnon-1-en-5-amine
CID 105039716
1-methoxy-N-methyl-3-(2-methylbutan-2-yloxy)propan-2-amine
CID 107506722
1-methoxy-N,7-dimethyloctan-2-amine
CID 83158137
1-(3,4-dimethoxyphenyl)-N,4,5,5-tetramethylhexan-2-amine
CID 63834170
3-methoxy-1-N,2-N-dimethyl-1-N-(3-methylbutan-2-yl)propane-1,2-diamine
CID 107505408
1-methoxy-N,2,6-trimethyloctan-4-amine
CID 105138500
7-methoxy-N,6-dimethylhept-1-en-4-amine
CID 105108659
3-methoxy-1-N,2-N-dimethyl-1-N-(4-methylpentan-2-yl)propane-1,2-diamine
CID 107505560
4-imino-1-methoxy-N-methylbutan-2-amine
CID 88905400

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-N,4,5,5-tetramethylhexan-2-amine?
The IUPAC name of 1-methoxy-N,4,5,5-tetramethylhexan-2-amine (CID 105008981) is 1-methoxy-N,4,5,5-tetramethylhexan-2-amine.
What is the SMILES notation for 1-methoxy-N,4,5,5-tetramethylhexan-2-amine?
The canonical SMILES for 1-methoxy-N,4,5,5-tetramethylhexan-2-amine is CNC(COC)CC(C)C(C)(C)C.
What is the InChIKey of 1-methoxy-N,4,5,5-tetramethylhexan-2-amine?
The InChIKey is OVJNPTHZNUQSLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO/c1-9(11(2,3)4)7-10(12-5)8-13-6/h9-10,12H,7-8H2,1-6H3.
What are the key properties of 1-methoxy-N,4,5,5-tetramethylhexan-2-amine?
1-methoxy-N,4,5,5-tetramethylhexan-2-amine has a molecular weight of 187.33 g/mol, XLogP of 2.29, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-N,4,5,5-tetramethylhexan-2-amine is sourced from PubChem (CID 105008981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).