4-[(dimethylamino)methyl]-2-methoxyphenol

C10H15NO2 — CID 10381432

IUPAC4-[(dimethylamino)methyl]-2-methoxyphenol
SMILESCOc1cc(CN(C)C)ccc1O
InChIInChI=1S/C10H15NO2/c1-11(2)7-8-4-5-9(12)10(6-8)13-3/h4-6,12H,7H2,1-3H3
InChIKeyCSCUIKCCBTYIMH-UHFFFAOYSA-N
MW181.23 g/mol
LogP1.46
Rot. Bonds3

About 4-[(dimethylamino)methyl]-2-methoxyphenol

4-[(dimethylamino)methyl]-2-methoxyphenol (PubChem CID 10381432) has the molecular formula C10H15NO2 and a molecular weight of 181.23 g/mol. Its IUPAC name is 4-[(dimethylamino)methyl]-2-methoxyphenol.

Molecular Properties

Compound Name4-[(dimethylamino)methyl]-2-methoxyphenol
PubChem CID10381432
Molecular FormulaC10H15NO2
Molecular Weight181.23 g/mol
Exact Mass181.11
IUPAC Name4-[(dimethylamino)methyl]-2-methoxyphenol
SMILESCOc1cc(CN(C)C)ccc1O
InChIInChI=1S/C10H15NO2/c1-11(2)7-8-4-5-9(12)10(6-8)13-3/h4-6,12H,7H2,1-3H3
InChIKeyCSCUIKCCBTYIMH-UHFFFAOYSA-N
XLogP1.46
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.23
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(dimethylamino)methyl]-2-methoxyphenol?
The IUPAC name of 4-[(dimethylamino)methyl]-2-methoxyphenol (CID 10381432) is 4-[(dimethylamino)methyl]-2-methoxyphenol.
What is the SMILES notation for 4-[(dimethylamino)methyl]-2-methoxyphenol?
The canonical SMILES for 4-[(dimethylamino)methyl]-2-methoxyphenol is COc1cc(CN(C)C)ccc1O.
What is the InChIKey of 4-[(dimethylamino)methyl]-2-methoxyphenol?
The InChIKey is CSCUIKCCBTYIMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2/c1-11(2)7-8-4-5-9(12)10(6-8)13-3/h4-6,12H,7H2,1-3H3.
What are the key properties of 4-[(dimethylamino)methyl]-2-methoxyphenol?
4-[(dimethylamino)methyl]-2-methoxyphenol has a molecular weight of 181.23 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(dimethylamino)methyl]-2-methoxyphenol is sourced from PubChem (CID 10381432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).