6-methoxy-2-(3-methoxy-2,2-dimethylpropyl)-5,5-dimethylhexan-1-amine

C15H33NO2 — CID 88558168

IUPAC6-methoxy-2-(3-methoxy-2,2-dimethylpropyl)-5,5-dimethylhexan-1-amine
SMILESCOCC(C)(C)CCC(CN)CC(C)(C)COC
InChIInChI=1S/C15H33NO2/c1-14(2,11-17-5)8-7-13(10-16)9-15(3,4)12-18-6/h13H,7-12,16H2,1-6H3
InChIKeyDMFSIYIMUOYHAX-UHFFFAOYSA-N
MW259.43 g/mol
LogP3.08
Rot. Bonds10

About 6-methoxy-2-(3-methoxy-2,2-dimethylpropyl)-5,5-dimethylhexan-1-amine

6-methoxy-2-(3-methoxy-2,2-dimethylpropyl)-5,5-dimethylhexan-1-amine (PubChem CID 88558168) has the molecular formula C15H33NO2 and a molecular weight of 259.43 g/mol. Its IUPAC name is 6-methoxy-2-(3-methoxy-2,2-dimethylpropyl)-5,5-dimethylhexan-1-amine.

Molecular Properties

Compound Name6-methoxy-2-(3-methoxy-2,2-dimethylpropyl)-5,5-dimethylhexan-1-amine
PubChem CID88558168
Molecular FormulaC15H33NO2
Molecular Weight259.43 g/mol
Exact Mass259.25
IUPAC Name6-methoxy-2-(3-methoxy-2,2-dimethylpropyl)-5,5-dimethylhexan-1-amine
SMILESCOCC(C)(C)CCC(CN)CC(C)(C)COC
InChIInChI=1S/C15H33NO2/c1-14(2,11-17-5)8-7-13(10-16)9-15(3,4)12-18-6/h13H,7-12,16H2,1-6H3
InChIKeyDMFSIYIMUOYHAX-UHFFFAOYSA-N
XLogP3.08
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.43
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-methoxy-2-(3-methoxy-2,2-dimethylpropyl)-5,5-dimethylhexan-1-amine with MolForge

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Related Compounds

10-Ethoxy-9,9-dimethyldecan-1-amine
CID 3085386
(2S,4R,6R,8S)-4-ethyl-2-fluoro-4,6-dimethyl-8-propoxydodecan-1-amine
CID 163926539
14-Ethoxy-13,13-dimethyltetradecan-1-amine
CID 111508
4-Fluoro-4-(methoxymethyl)-6-methylnonan-1-amine
CID 103392364
4-Fluoro-4-(methoxymethyl)-7-methyloctan-1-amine
CID 103392394
4-Fluoro-4-(methoxymethyl)tridecan-1-amine
CID 103392396
4-Fluoro-4-(methoxymethyl)-7,7-dimethyloctan-1-amine
CID 103392447
4-Fluoro-4-(methoxymethyl)-8-methylnonan-1-amine
CID 103392547
6-Ethyl-4-fluoro-4-(methoxymethyl)decan-1-amine
CID 103392578
1-Methoxy-3,8-dimethylnonan-1-amine
CID 89012587
(2S)-2-methyl-3-[(3R)-oxepan-3-yl]propan-1-amine
CID 89687594
(6S)-N-(2,2-dimethylpropyl)-6-(2-methoxyethyl)-8,8-dimethylnonan-1-amine
CID 118887832

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-(3-methoxy-2,2-dimethylpropyl)-5,5-dimethylhexan-1-amine?
The IUPAC name of 6-methoxy-2-(3-methoxy-2,2-dimethylpropyl)-5,5-dimethylhexan-1-amine (CID 88558168) is 6-methoxy-2-(3-methoxy-2,2-dimethylpropyl)-5,5-dimethylhexan-1-amine.
What is the SMILES notation for 6-methoxy-2-(3-methoxy-2,2-dimethylpropyl)-5,5-dimethylhexan-1-amine?
The canonical SMILES for 6-methoxy-2-(3-methoxy-2,2-dimethylpropyl)-5,5-dimethylhexan-1-amine is COCC(C)(C)CCC(CN)CC(C)(C)COC.
What is the InChIKey of 6-methoxy-2-(3-methoxy-2,2-dimethylpropyl)-5,5-dimethylhexan-1-amine?
The InChIKey is DMFSIYIMUOYHAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO2/c1-14(2,11-17-5)8-7-13(10-16)9-15(3,4)12-18-6/h13H,7-12,16H2,1-6H3.
What are the key properties of 6-methoxy-2-(3-methoxy-2,2-dimethylpropyl)-5,5-dimethylhexan-1-amine?
6-methoxy-2-(3-methoxy-2,2-dimethylpropyl)-5,5-dimethylhexan-1-amine has a molecular weight of 259.43 g/mol, XLogP of 3.08, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-(3-methoxy-2,2-dimethylpropyl)-5,5-dimethylhexan-1-amine is sourced from PubChem (CID 88558168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).