2-[(2-methoxyphenyl)methyl-methylamino]ethanol

C11H17NO2 — CID 14964114

IUPAC2-[(2-methoxyphenyl)methyl-methylamino]ethanol
SMILESCOc1ccccc1CN(C)CCO
InChIInChI=1S/C11H17NO2/c1-12(7-8-13)9-10-5-3-4-6-11(10)14-2/h3-6,13H,7-9H2,1-2H3
InChIKeyIRCVWAUYLSQYCW-UHFFFAOYSA-N
MW195.26 g/mol
LogP1.12
Rot. Bonds5

About 2-[(2-methoxyphenyl)methyl-methylamino]ethanol

2-[(2-methoxyphenyl)methyl-methylamino]ethanol (PubChem CID 14964114) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is 2-[(2-methoxyphenyl)methyl-methylamino]ethanol.

Molecular Properties

Compound Name2-[(2-methoxyphenyl)methyl-methylamino]ethanol
PubChem CID14964114
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Name2-[(2-methoxyphenyl)methyl-methylamino]ethanol
SMILESCOc1ccccc1CN(C)CCO
InChIInChI=1S/C11H17NO2/c1-12(7-8-13)9-10-5-3-4-6-11(10)14-2/h3-6,13H,7-9H2,1-2H3
InChIKeyIRCVWAUYLSQYCW-UHFFFAOYSA-N
XLogP1.12
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxyphenyl)methyl-methylamino]ethanol?
The IUPAC name of 2-[(2-methoxyphenyl)methyl-methylamino]ethanol (CID 14964114) is 2-[(2-methoxyphenyl)methyl-methylamino]ethanol.
What is the SMILES notation for 2-[(2-methoxyphenyl)methyl-methylamino]ethanol?
The canonical SMILES for 2-[(2-methoxyphenyl)methyl-methylamino]ethanol is COc1ccccc1CN(C)CCO.
What is the InChIKey of 2-[(2-methoxyphenyl)methyl-methylamino]ethanol?
The InChIKey is IRCVWAUYLSQYCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-12(7-8-13)9-10-5-3-4-6-11(10)14-2/h3-6,13H,7-9H2,1-2H3.
What are the key properties of 2-[(2-methoxyphenyl)methyl-methylamino]ethanol?
2-[(2-methoxyphenyl)methyl-methylamino]ethanol has a molecular weight of 195.26 g/mol, XLogP of 1.12, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxyphenyl)methyl-methylamino]ethanol is sourced from PubChem (CID 14964114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).