N,N-dimethyl-2-(3-methylphenoxy)ethanamine

HCID 5261925

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Basic information

CAS: 2455-15-4
Standard SMILES: Cc1cccc(OCCN(C)C)c1
InChIKey: YSOXHWYLPZLCFY-UHFFFAOYSA-N
Molecular formula: C11H17NO
Average molar mass: 179.26 g/mol
Monoisotopic mass: 179.13101417

Names & identifiers

Preferred name: N,N-dimethyl-2-(3-methylphenoxy)ethanamine
IUPAC: N,N-dimethyl-2-(3-methylphenoxy)ethanamine

Names & synonyms

2455-15-4N,N-dimethyl-2-(3-methylphenoxy)ethanamineSCHEMBL8360713DTXSID90876579AKOS002774314N,N-Dimethyl-2-(3-methylphenoxy)ethan-1-amineETHANAMINE, N,N-DIMETHYL-2-(3-METHYLPHENOXY)-

Database identifiers

CAS: 2455-15-4
PubChem CID: 5261925
DTXSID: DTXSID90876579
Nikkaji: J618.343C

Properties

Computed structural properties

XLogP: 2.7
Topological polar surface area: 12.5 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 4
Heavy atoms: 13
Formal charge: 0
Complexity: 136

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