N,N-dimethyl-2-phenoxyethanamine

C10H15NO — CID 26050

IUPACN,N-dimethyl-2-phenoxyethanamine
SMILESCN(C)CCOc1ccccc1
InChIInChI=1S/C10H15NO/c1-11(2)8-9-12-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3
InChIKeyRUHVDRGWCIAFLG-UHFFFAOYSA-N
MW165.24 g/mol
LogP1.63
Rot. Bonds4

About N,N-dimethyl-2-phenoxyethanamine

N,N-dimethyl-2-phenoxyethanamine (PubChem CID 26050) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is N,N-dimethyl-2-phenoxyethanamine.

Molecular Properties

Compound NameN,N-dimethyl-2-phenoxyethanamine
PubChem CID26050
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC NameN,N-dimethyl-2-phenoxyethanamine
SMILESCN(C)CCOc1ccccc1
InChIInChI=1S/C10H15NO/c1-11(2)8-9-12-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3
InChIKeyRUHVDRGWCIAFLG-UHFFFAOYSA-N
XLogP1.63
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-phenoxyethanamine?
The IUPAC name of N,N-dimethyl-2-phenoxyethanamine (CID 26050) is N,N-dimethyl-2-phenoxyethanamine.
What is the SMILES notation for N,N-dimethyl-2-phenoxyethanamine?
The canonical SMILES for N,N-dimethyl-2-phenoxyethanamine is CN(C)CCOc1ccccc1.
What is the InChIKey of N,N-dimethyl-2-phenoxyethanamine?
The InChIKey is RUHVDRGWCIAFLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO/c1-11(2)8-9-12-10-6-4-3-5-7-10/h3-7H,8-9H2,1-2H3.
What are the key properties of N,N-dimethyl-2-phenoxyethanamine?
N,N-dimethyl-2-phenoxyethanamine has a molecular weight of 165.24 g/mol, XLogP of 1.63, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-phenoxyethanamine is sourced from PubChem (CID 26050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).