1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine

C12H19NO2 — CID 65364966

IUPAC1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine
SMILESCOCOc1ccc(C)cc1CC(C)N
InChIInChI=1S/C12H19NO2/c1-9-4-5-12(15-8-14-3)11(6-9)7-10(2)13/h4-6,10H,7-8,13H2,1-3H3
InChIKeyRZNMSYYMMRWSKO-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.87
Rot. Bonds5

About 1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine

1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine (PubChem CID 65364966) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine.

Molecular Properties

Compound Name1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine
PubChem CID65364966
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine
SMILESCOCOc1ccc(C)cc1CC(C)N
InChIInChI=1S/C12H19NO2/c1-9-4-5-12(15-8-14-3)11(6-9)7-10(2)13/h4-6,10H,7-8,13H2,1-3H3
InChIKeyRZNMSYYMMRWSKO-UHFFFAOYSA-N
XLogP1.87
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.87
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-methyl-2-(3-methylbutoxy)phenyl]propan-2-amine
CID 55200535
1-[2-(methoxymethoxy)-5-methylphenyl]ethanamine
CID 65365858
1-[2-[(3,5-dimethylphenyl)methoxy]-5-methylphenyl]propan-2-amine
CID 63325862
2-[2-(2-aminopropyl)-4-methylphenoxy]acetonitrile
CID 63326461
1-(5-methyl-2-prop-2-ynoxyphenyl)propan-2-amine
CID 63326075
2-(chloromethyl)-1-(methoxymethoxy)-4-methylbenzene
CID 65364631
ethyl 2-[2-(2-aminopropyl)-4-methylphenoxy]acetate
CID 63326114
1-[2-(cyclobutylmethoxy)-5-methylphenyl]propan-2-amine
CID 65459757
1-[5-methyl-2-(3-methylsulfonylpropoxy)phenyl]propan-2-amine
CID 63326330
1-[2-[(2-chlorophenyl)methoxy]-5-methylphenyl]propan-2-amine
CID 63326375
1-[2-[(2-fluorophenyl)methoxy]-5-methylphenyl]propan-2-amine
CID 63326290
1-[2-[(6-methoxy-2-pyridinyl)methoxy]-5-methylphenyl]propan-2-amine
CID 63985125

Frequently Asked Questions

What is the IUPAC name of 1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine?
The IUPAC name of 1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine (CID 65364966) is 1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine.
What is the SMILES notation for 1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine?
The canonical SMILES for 1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine is COCOc1ccc(C)cc1CC(C)N.
What is the InChIKey of 1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine?
The InChIKey is RZNMSYYMMRWSKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-9-4-5-12(15-8-14-3)11(6-9)7-10(2)13/h4-6,10H,7-8,13H2,1-3H3.
What are the key properties of 1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine?
1-[2-(methoxymethoxy)-5-methylphenyl]propan-2-amine has a molecular weight of 209.29 g/mol, XLogP of 1.87, 5 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]propan-2-amine is sourced from PubChem (CID 65364966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).