methoxy-(4-methoxy-2,5-dimethylphenyl)methanamine

C11H17NO2 — CID 116947261

IUPACmethoxy-(4-methoxy-2,5-dimethylphenyl)methanamine
SMILESCOc1cc(C)c(C(N)OC)cc1C
InChIInChI=1S/C11H17NO2/c1-7-6-10(13-3)8(2)5-9(7)11(12)14-4/h5-6,11H,12H2,1-4H3
InChIKeyYVWDTRFBPLUGOP-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.92
Rot. Bonds3

About methoxy-(4-methoxy-2,5-dimethylphenyl)methanamine

methoxy-(4-methoxy-2,5-dimethylphenyl)methanamine (PubChem CID 116947261) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is methoxy-(4-methoxy-2,5-dimethylphenyl)methanamine.

Molecular Properties

Compound Namemethoxy-(4-methoxy-2,5-dimethylphenyl)methanamine
PubChem CID116947261
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Namemethoxy-(4-methoxy-2,5-dimethylphenyl)methanamine
SMILESCOc1cc(C)c(C(N)OC)cc1C
InChIInChI=1S/C11H17NO2/c1-7-6-10(13-3)8(2)5-9(7)11(12)14-4/h5-6,11H,12H2,1-4H3
InChIKeyYVWDTRFBPLUGOP-UHFFFAOYSA-N
XLogP1.92
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze methoxy-(4-methoxy-2,5-dimethylphenyl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

methoxy-(2-methoxy-4,5-dimethylphenyl)methanamine
CID 116947260
(1R)-1-(4-methoxy-2,5-dimethylphenyl)ethanamine
CID 59272895
1-(dimethoxymethyl)-4-methoxy-2,5-dimethylbenzene
CID 20549048
(3,5-dimethylphenyl)-(4-methoxy-2,5-dimethylphenyl)methanamine
CID 105032704
amino-(2-methoxy-4,5-dimethylphenyl)methanethiol
CID 116939456
(1R)-1-(4-methoxy-2,5-dimethylphenyl)ethanol
CID 93182220
1,4-dimethoxy-2,5-dimethylbenzene;dihydrochloride
CID 172845974
2-methoxy-1-(4-methoxy-2,5-dimethylphenyl)-2-phenylethanamine
CID 116772886
(2,4-difluoro-5-methylphenyl)-(4-methoxy-2,5-dimethylphenyl)methanamine
CID 105032726
3-amino-3-(4-methoxy-2,5-dimethylphenyl)propanamide
CID 116850930
1-(4-methoxy-2,5-dimethylphenyl)-2,2-dimethylbutan-1-amine
CID 105032908
3-amino-3-(4-methoxy-2,5-dimethylphenyl)-2-methylpropanoic acid
CID 116938026

Frequently Asked Questions

What is the IUPAC name of methoxy-(4-methoxy-2,5-dimethylphenyl)methanamine?
The IUPAC name of methoxy-(4-methoxy-2,5-dimethylphenyl)methanamine (CID 116947261) is methoxy-(4-methoxy-2,5-dimethylphenyl)methanamine.
What is the SMILES notation for methoxy-(4-methoxy-2,5-dimethylphenyl)methanamine?
The canonical SMILES for methoxy-(4-methoxy-2,5-dimethylphenyl)methanamine is COc1cc(C)c(C(N)OC)cc1C.
What is the InChIKey of methoxy-(4-methoxy-2,5-dimethylphenyl)methanamine?
The InChIKey is YVWDTRFBPLUGOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-7-6-10(13-3)8(2)5-9(7)11(12)14-4/h5-6,11H,12H2,1-4H3.
What are the key properties of methoxy-(4-methoxy-2,5-dimethylphenyl)methanamine?
methoxy-(4-methoxy-2,5-dimethylphenyl)methanamine has a molecular weight of 195.26 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methoxy-(4-methoxy-2,5-dimethylphenyl)methanamine is sourced from PubChem (CID 116947261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).