2-(2-ethylhexoxy)-N-methyl-2-phenylethanamine

C17H29NO — CID 62110716

IUPAC2-(2-ethylhexoxy)-N-methyl-2-phenylethanamine
SMILESCCCCC(CC)COC(CNC)c1ccccc1
InChIInChI=1S/C17H29NO/c1-4-6-10-15(5-2)14-19-17(13-18-3)16-11-8-7-9-12-16/h7-9,11-12,15,17-18H,4-6,10,13-14H2,1-3H3
InChIKeyUURUFUMDAHHYLM-UHFFFAOYSA-N
MW263.43 g/mol
LogP4.18
Rot. Bonds10

About 2-(2-ethylhexoxy)-N-methyl-2-phenylethanamine

2-(2-ethylhexoxy)-N-methyl-2-phenylethanamine (PubChem CID 62110716) has the molecular formula C17H29NO and a molecular weight of 263.43 g/mol. Its IUPAC name is 2-(2-ethylhexoxy)-N-methyl-2-phenylethanamine.

Molecular Properties

Compound Name2-(2-ethylhexoxy)-N-methyl-2-phenylethanamine
PubChem CID62110716
Molecular FormulaC17H29NO
Molecular Weight263.43 g/mol
Exact Mass263.22
IUPAC Name2-(2-ethylhexoxy)-N-methyl-2-phenylethanamine
SMILESCCCCC(CC)COC(CNC)c1ccccc1
InChIInChI=1S/C17H29NO/c1-4-6-10-15(5-2)14-19-17(13-18-3)16-11-8-7-9-12-16/h7-9,11-12,15,17-18H,4-6,10,13-14H2,1-3H3
InChIKeyUURUFUMDAHHYLM-UHFFFAOYSA-N
XLogP4.18
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromophenyl)-2-(2-ethylhexoxy)-N-methylethanamine
CID 63474642
2-hexoxy-N-methyl-2-phenylethanamine
CID 55036294
2-(2-ethylhexoxy)-N-methylpropan-1-amine
CID 62336461
1-[2-bromo-1-(2-ethylhexoxy)ethyl]-3-methylbenzene
CID 63475657
3-ethyl-N-methyl-1-phenylheptan-1-amine
CID 63412711
2-benzyl-N-methylhexan-1-amine
CID 62529253
2-(2-bromophenyl)-2-(2-ethylhexoxy)ethanamine
CID 55191674
2-ethyl-N-(2-methyl-1-phenylpropyl)hexan-1-amine
CID 43767516
1-O-(2-ethylhexyl) 4-O-(1-phenylpropyl) (E)-but-2-enedioate
CID 91701340
N-methyl-2-(2,2,3,3,3-pentafluoropropoxy)-2-phenylethanamine
CID 103725392
CID 174494301
CID 174494301
1-(2-methoxyethoxy)pentylbenzene
CID 10977044

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylhexoxy)-N-methyl-2-phenylethanamine?
The IUPAC name of 2-(2-ethylhexoxy)-N-methyl-2-phenylethanamine (CID 62110716) is 2-(2-ethylhexoxy)-N-methyl-2-phenylethanamine.
What is the SMILES notation for 2-(2-ethylhexoxy)-N-methyl-2-phenylethanamine?
The canonical SMILES for 2-(2-ethylhexoxy)-N-methyl-2-phenylethanamine is CCCCC(CC)COC(CNC)c1ccccc1.
What is the InChIKey of 2-(2-ethylhexoxy)-N-methyl-2-phenylethanamine?
The InChIKey is UURUFUMDAHHYLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H29NO/c1-4-6-10-15(5-2)14-19-17(13-18-3)16-11-8-7-9-12-16/h7-9,11-12,15,17-18H,4-6,10,13-14H2,1-3H3.
What are the key properties of 2-(2-ethylhexoxy)-N-methyl-2-phenylethanamine?
2-(2-ethylhexoxy)-N-methyl-2-phenylethanamine has a molecular weight of 263.43 g/mol, XLogP of 4.18, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylhexoxy)-N-methyl-2-phenylethanamine is sourced from PubChem (CID 62110716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).