1-[2-(methoxymethoxy)-5-methylphenyl]ethanamine

C11H17NO2 — CID 65365858

IUPAC1-[2-(methoxymethoxy)-5-methylphenyl]ethanamine
SMILESCOCOc1ccc(C)cc1C(C)N
InChIInChI=1S/C11H17NO2/c1-8-4-5-11(14-7-13-3)10(6-8)9(2)12/h4-6,9H,7,12H2,1-3H3
InChIKeyHCDGVYFQQPXJQQ-UHFFFAOYSA-N
MW195.26 g/mol
LogP2.00
Rot. Bonds4

About 1-[2-(methoxymethoxy)-5-methylphenyl]ethanamine

1-[2-(methoxymethoxy)-5-methylphenyl]ethanamine (PubChem CID 65365858) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 1-[2-(methoxymethoxy)-5-methylphenyl]ethanamine.

Molecular Properties

Compound Name1-[2-(methoxymethoxy)-5-methylphenyl]ethanamine
PubChem CID65365858
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name1-[2-(methoxymethoxy)-5-methylphenyl]ethanamine
SMILESCOCOc1ccc(C)cc1C(C)N
InChIInChI=1S/C11H17NO2/c1-8-4-5-11(14-7-13-3)10(6-8)9(2)12/h4-6,9H,7,12H2,1-3H3
InChIKeyHCDGVYFQQPXJQQ-UHFFFAOYSA-N
XLogP2.00
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-[5-bromo-2-(methoxymethoxy)phenyl]ethanamine
CID 65365311
1-[5-methyl-2-[(4-methylphenyl)methoxy]phenyl]ethanamine
CID 43505054
1-[5-methyl-2-(3-methylbutoxy)phenyl]ethanamine
CID 43504992
1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine
CID 65364966
(1S)-1-[5-methyl-2-(pyrimidin-2-ylmethoxy)phenyl]ethanamine
CID 78936782
(1S)-1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]ethanamine
CID 78936431
1-(5-methyl-2-prop-2-ynoxyphenyl)ethanamine
CID 60889989
(1S)-1-[2-(3-fluoropropoxy)-5-methylphenyl]ethanamine
CID 81106656
1-[2-[2-(diethylamino)ethoxy]-5-methylphenyl]ethanamine
CID 43505039
(1S)-1-[5-methyl-2-(2-methylsulfanylethoxy)phenyl]ethanamine
CID 104863256
(1S)-1-(2-but-2-ynoxy-5-methylphenyl)ethanamine
CID 78936543
(1R)-1-(2-but-2-ynoxy-5-methylphenyl)ethanamine
CID 63367180

Frequently Asked Questions

What is the IUPAC name of 1-[2-(methoxymethoxy)-5-methylphenyl]ethanamine?
The IUPAC name of 1-[2-(methoxymethoxy)-5-methylphenyl]ethanamine (CID 65365858) is 1-[2-(methoxymethoxy)-5-methylphenyl]ethanamine.
What is the SMILES notation for 1-[2-(methoxymethoxy)-5-methylphenyl]ethanamine?
The canonical SMILES for 1-[2-(methoxymethoxy)-5-methylphenyl]ethanamine is COCOc1ccc(C)cc1C(C)N.
What is the InChIKey of 1-[2-(methoxymethoxy)-5-methylphenyl]ethanamine?
The InChIKey is HCDGVYFQQPXJQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-8-4-5-11(14-7-13-3)10(6-8)9(2)12/h4-6,9H,7,12H2,1-3H3.
What are the key properties of 1-[2-(methoxymethoxy)-5-methylphenyl]ethanamine?
1-[2-(methoxymethoxy)-5-methylphenyl]ethanamine has a molecular weight of 195.26 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(methoxymethoxy)-5-methylphenyl]ethanamine is sourced from PubChem (CID 65365858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).