1-(2-methoxyphenyl)-N,N-dimethylmethanamine

C10H15NO — CID 547328

IUPAC1-(2-methoxyphenyl)-N,N-dimethylmethanamine
SMILESCOc1ccccc1CN(C)C
InChIInChI=1S/C10H15NO/c1-11(2)8-9-6-4-5-7-10(9)12-3/h4-7H,8H2,1-3H3
InChIKeySXQUOALEYCCTHW-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.76
Rot. Bonds3

About 1-(2-methoxyphenyl)-N,N-dimethylmethanamine

1-(2-methoxyphenyl)-N,N-dimethylmethanamine (PubChem CID 547328) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-(2-methoxyphenyl)-N,N-dimethylmethanamine
PubChem CID547328
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name1-(2-methoxyphenyl)-N,N-dimethylmethanamine
SMILESCOc1ccccc1CN(C)C
InChIInChI=1S/C10H15NO/c1-11(2)8-9-6-4-5-7-10(9)12-3/h4-7H,8H2,1-3H3
InChIKeySXQUOALEYCCTHW-UHFFFAOYSA-N
XLogP1.76
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyphenyl)-N,N-dimethylmethanamine?
The IUPAC name of 1-(2-methoxyphenyl)-N,N-dimethylmethanamine (CID 547328) is 1-(2-methoxyphenyl)-N,N-dimethylmethanamine.
What is the SMILES notation for 1-(2-methoxyphenyl)-N,N-dimethylmethanamine?
The canonical SMILES for 1-(2-methoxyphenyl)-N,N-dimethylmethanamine is COc1ccccc1CN(C)C.
What is the InChIKey of 1-(2-methoxyphenyl)-N,N-dimethylmethanamine?
The InChIKey is SXQUOALEYCCTHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-11(2)8-9-6-4-5-7-10(9)12-3/h4-7H,8H2,1-3H3.
What are the key properties of 1-(2-methoxyphenyl)-N,N-dimethylmethanamine?
1-(2-methoxyphenyl)-N,N-dimethylmethanamine has a molecular weight of 165.24 g/mol, XLogP of 1.76, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-N,N-dimethylmethanamine is sourced from PubChem (CID 547328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).