[2,4-dimethoxy-6-(methoxymethyl)phenyl]methanamine

C11H17NO3 — CID 117301737

IUPAC[2,4-dimethoxy-6-(methoxymethyl)phenyl]methanamine
SMILESCOCc1cc(OC)cc(OC)c1CN
InChIInChI=1S/C11H17NO3/c1-13-7-8-4-9(14-2)5-11(15-3)10(8)6-12/h4-5H,6-7,12H2,1-3H3
InChIKeyVARNZJDVJCRHPZ-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.31
Rot. Bonds5

About [2,4-dimethoxy-6-(methoxymethyl)phenyl]methanamine

[2,4-dimethoxy-6-(methoxymethyl)phenyl]methanamine (PubChem CID 117301737) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is [2,4-dimethoxy-6-(methoxymethyl)phenyl]methanamine.

Molecular Properties

Compound Name[2,4-dimethoxy-6-(methoxymethyl)phenyl]methanamine
PubChem CID117301737
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Name[2,4-dimethoxy-6-(methoxymethyl)phenyl]methanamine
SMILESCOCc1cc(OC)cc(OC)c1CN
InChIInChI=1S/C11H17NO3/c1-13-7-8-4-9(14-2)5-11(15-3)10(8)6-12/h4-5H,6-7,12H2,1-3H3
InChIKeyVARNZJDVJCRHPZ-UHFFFAOYSA-N
XLogP1.31
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2,4-dimethoxy-6-(methoxymethyl)phenyl]propanal
CID 117349022
1,5-dimethoxy-2-(methoxymethyl)-3-methylbenzene
CID 116932273
3-[2,4-dimethoxy-6-(methoxymethyl)phenyl]butan-1-amine
CID 117386595
3-amino-3-[2,4-dimethoxy-6-(methoxymethyl)phenyl]propanoic acid
CID 117426323
4-methoxy-2,6-bis(methoxymethyl)phenol
CID 138470113
4-(2-ethyl-3,5-dimethoxyphenyl)butan-1-amine
CID 117347671
2-(2-ethyl-3,5-dimethoxyphenyl)acetic acid
CID 117321866
2-(iodomethyl)-1,3,5-trimethoxybenzene
CID 10946751
(4-methoxy-2,6-dimethylphenyl)methanamine
CID 82266532
(2,6-dimethoxy-4-methylphenyl)methanamine
CID 58024962
[4-(aminomethyl)-3,5-dimethoxyphenoxy]boronic acid
CID 174501310
3-(aminomethyl)-5,7-dimethoxy-1,4-dimethylquinolin-2-one
CID 84638829

Frequently Asked Questions

What is the IUPAC name of [2,4-dimethoxy-6-(methoxymethyl)phenyl]methanamine?
The IUPAC name of [2,4-dimethoxy-6-(methoxymethyl)phenyl]methanamine (CID 117301737) is [2,4-dimethoxy-6-(methoxymethyl)phenyl]methanamine.
What is the SMILES notation for [2,4-dimethoxy-6-(methoxymethyl)phenyl]methanamine?
The canonical SMILES for [2,4-dimethoxy-6-(methoxymethyl)phenyl]methanamine is COCc1cc(OC)cc(OC)c1CN.
What is the InChIKey of [2,4-dimethoxy-6-(methoxymethyl)phenyl]methanamine?
The InChIKey is VARNZJDVJCRHPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c1-13-7-8-4-9(14-2)5-11(15-3)10(8)6-12/h4-5H,6-7,12H2,1-3H3.
What are the key properties of [2,4-dimethoxy-6-(methoxymethyl)phenyl]methanamine?
[2,4-dimethoxy-6-(methoxymethyl)phenyl]methanamine has a molecular weight of 211.26 g/mol, XLogP of 1.31, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2,4-dimethoxy-6-(methoxymethyl)phenyl]methanamine is sourced from PubChem (CID 117301737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).