2-methoxy-N,5,5-trimethylhexan-1-amine

C10H23NO — CID 177141375

IUPAC2-methoxy-N,5,5-trimethylhexan-1-amine
SMILESCNCC(CCC(C)(C)C)OC
InChIInChI=1S/C10H23NO/c1-10(2,3)7-6-9(12-5)8-11-4/h9,11H,6-8H2,1-5H3
InChIKeyALQCUPDXWSMFGS-UHFFFAOYSA-N
MW173.30 g/mol
LogP2.05
Rot. Bonds5

About 2-methoxy-N,5,5-trimethylhexan-1-amine

2-methoxy-N,5,5-trimethylhexan-1-amine (PubChem CID 177141375) has the molecular formula C10H23NO and a molecular weight of 173.30 g/mol. Its IUPAC name is 2-methoxy-N,5,5-trimethylhexan-1-amine.

Molecular Properties

Compound Name2-methoxy-N,5,5-trimethylhexan-1-amine
PubChem CID177141375
Molecular FormulaC10H23NO
Molecular Weight173.30 g/mol
Exact Mass173.18
IUPAC Name2-methoxy-N,5,5-trimethylhexan-1-amine
SMILESCNCC(CCC(C)(C)C)OC
InChIInChI=1S/C10H23NO/c1-10(2,3)7-6-9(12-5)8-11-4/h9,11H,6-8H2,1-5H3
InChIKeyALQCUPDXWSMFGS-UHFFFAOYSA-N
XLogP2.05
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.30
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,2-dimethoxy-5,5-dimethylhexane
CID 154608131
(2S)-2-methoxy-3-(methylamino)propan-1-ol
CID 176680341
(6R)-6-methoxy-2,2,12-trimethyltridecane
CID 118887775
(2S,5S)-2-methoxy-N,5-dimethylheptan-1-amine
CID 178044183
2-methoxy-N'-methylpropane-1,3-diamine
CID 20763150
(4S)-4-methoxy-8,8-dimethylnonan-1-ol
CID 118887633
2-methoxy-N,6,6-trimethylheptan-3-amine
CID 79616446
2-methoxy-5,5-dimethyl-1-pent-1-en-2-yloxyhexane
CID 126490103
(E)-5-methoxy-8,8-dimethylnon-2-enal
CID 87291744
3-methoxy-N,2,2,7,7-pentamethyloctan-4-amine
CID 116724435
2,2,7,7-tetramethyl-4-(2,2,7,7-tetramethyloctan-4-ylperoxy)octane
CID 175001131
2,2-dimethyl-5-[(2-methylpropan-2-yl)oxy]hexane
CID 159070558

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N,5,5-trimethylhexan-1-amine?
The IUPAC name of 2-methoxy-N,5,5-trimethylhexan-1-amine (CID 177141375) is 2-methoxy-N,5,5-trimethylhexan-1-amine.
What is the SMILES notation for 2-methoxy-N,5,5-trimethylhexan-1-amine?
The canonical SMILES for 2-methoxy-N,5,5-trimethylhexan-1-amine is CNCC(CCC(C)(C)C)OC.
What is the InChIKey of 2-methoxy-N,5,5-trimethylhexan-1-amine?
The InChIKey is ALQCUPDXWSMFGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23NO/c1-10(2,3)7-6-9(12-5)8-11-4/h9,11H,6-8H2,1-5H3.
What are the key properties of 2-methoxy-N,5,5-trimethylhexan-1-amine?
2-methoxy-N,5,5-trimethylhexan-1-amine has a molecular weight of 173.30 g/mol, XLogP of 2.05, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N,5,5-trimethylhexan-1-amine is sourced from PubChem (CID 177141375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).