6-methoxy-2-methylhexan-2-amine

C8H19NO — CID 94975413

IUPAC6-methoxy-2-methylhexan-2-amine
SMILESCOCCCCC(C)(C)N
InChIInChI=1S/C8H19NO/c1-8(2,9)6-4-5-7-10-3/h4-7,9H2,1-3H3
InChIKeyLDPABNUFHVNFTC-UHFFFAOYSA-N
MW145.25 g/mol
LogP1.54
Rot. Bonds5

About 6-methoxy-2-methylhexan-2-amine

6-methoxy-2-methylhexan-2-amine (PubChem CID 94975413) has the molecular formula C8H19NO and a molecular weight of 145.25 g/mol. Its IUPAC name is 6-methoxy-2-methylhexan-2-amine.

Molecular Properties

Compound Name6-methoxy-2-methylhexan-2-amine
PubChem CID94975413
Molecular FormulaC8H19NO
Molecular Weight145.25 g/mol
Exact Mass145.15
IUPAC Name6-methoxy-2-methylhexan-2-amine
SMILESCOCCCCC(C)(C)N
InChIInChI=1S/C8H19NO/c1-8(2,9)6-4-5-7-10-3/h4-7,9H2,1-3H3
InChIKeyLDPABNUFHVNFTC-UHFFFAOYSA-N
XLogP1.54
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.25
LogP ≤ 51.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

7-methoxy-3-methylheptan-3-amine
CID 104650485
1-(4-methoxybutoxy)-2-methylpropan-2-amine
CID 104648280
6-methoxy-2,2-dimethylhexan-1-amine
CID 104649285
3-ethyl-7-methoxyheptan-3-amine
CID 104650482
1,6-dimethoxy-6-methylheptane
CID 89190127
6-methoxy-2-methyl-2-propylhexan-1-amine
CID 104649289
1,5-dimethoxy-3-methylpentan-3-amine
CID 114997128
1-N-(2-methoxyethyl)-3-methylbutane-1,3-diamine
CID 64681637
1-methoxy-3-methyldodecan-3-amine
CID 62620545
1-fluoro-4-methoxybutane
CID 20582799
2-amino-6-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylhexanamide
CID 104565103
2-methylpentacosan-2-amine;hydrochloride
CID 173079320

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-methylhexan-2-amine?
The IUPAC name of 6-methoxy-2-methylhexan-2-amine (CID 94975413) is 6-methoxy-2-methylhexan-2-amine.
What is the SMILES notation for 6-methoxy-2-methylhexan-2-amine?
The canonical SMILES for 6-methoxy-2-methylhexan-2-amine is COCCCCC(C)(C)N.
What is the InChIKey of 6-methoxy-2-methylhexan-2-amine?
The InChIKey is LDPABNUFHVNFTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO/c1-8(2,9)6-4-5-7-10-3/h4-7,9H2,1-3H3.
What are the key properties of 6-methoxy-2-methylhexan-2-amine?
6-methoxy-2-methylhexan-2-amine has a molecular weight of 145.25 g/mol, XLogP of 1.54, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-methylhexan-2-amine is sourced from PubChem (CID 94975413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).