1-[2-[1-(ethylamino)ethyl]phenoxy]propan-2-ol

C13H21NO2 — CID 60882508

IUPAC1-[2-[1-(ethylamino)ethyl]phenoxy]propan-2-ol
SMILESCCNC(C)c1ccccc1OCC(C)O
InChIInChI=1S/C13H21NO2/c1-4-14-11(3)12-7-5-6-8-13(12)16-9-10(2)15/h5-8,10-11,14-15H,4,9H2,1-3H3
InChIKeyDQCQTVJVPSEBKN-UHFFFAOYSA-N
MW223.32 g/mol
LogP2.12
Rot. Bonds6

About 1-[2-[1-(ethylamino)ethyl]phenoxy]propan-2-ol

1-[2-[1-(ethylamino)ethyl]phenoxy]propan-2-ol (PubChem CID 60882508) has the molecular formula C13H21NO2 and a molecular weight of 223.32 g/mol. Its IUPAC name is 1-[2-[1-(ethylamino)ethyl]phenoxy]propan-2-ol.

Molecular Properties

Compound Name1-[2-[1-(ethylamino)ethyl]phenoxy]propan-2-ol
PubChem CID60882508
Molecular FormulaC13H21NO2
Molecular Weight223.32 g/mol
Exact Mass223.16
IUPAC Name1-[2-[1-(ethylamino)ethyl]phenoxy]propan-2-ol
SMILESCCNC(C)c1ccccc1OCC(C)O
InChIInChI=1S/C13H21NO2/c1-4-14-11(3)12-7-5-6-8-13(12)16-9-10(2)15/h5-8,10-11,14-15H,4,9H2,1-3H3
InChIKeyDQCQTVJVPSEBKN-UHFFFAOYSA-N
XLogP2.12
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.32
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-1-[2-(2-methylpropoxy)phenyl]ethanamine
CID 43279591
(2R)-1-[1-(2-ethoxyphenyl)ethylamino]propan-2-ol
CID 103906642
N-ethyl-1-[2-[2-(2-methylpropoxy)ethoxy]phenyl]ethanamine
CID 106447883
1-(2-but-3-ynoxyphenyl)-N-ethylethanamine
CID 60882512
N-ethyl-1-[2-[(4-methylphenyl)methoxy]phenyl]ethanamine
CID 43279645
5-[1-(2-ethoxyphenyl)ethylamino]pentan-2-ol
CID 107270389
(1S)-1-[2-[(2R)-butan-2-yl]oxyphenyl]-N-ethylethanamine
CID 93007357
N-ethyl-1-[2-[(2-fluorophenyl)methoxy]phenyl]ethanamine
CID 43279629
1-[2-(2-bromophenoxy)phenyl]-N-ethylethanamine
CID 43284836
N-ethyl-1-[2-(4-methoxyphenoxy)phenyl]ethanamine
CID 43285624
1-[2-(2,6-dimethylphenoxy)phenyl]-N-ethylethanamine
CID 43285276
1-(2-methoxyphenoxy)propan-2-ol
CID 22036327

Frequently Asked Questions

What is the IUPAC name of 1-[2-[1-(ethylamino)ethyl]phenoxy]propan-2-ol?
The IUPAC name of 1-[2-[1-(ethylamino)ethyl]phenoxy]propan-2-ol (CID 60882508) is 1-[2-[1-(ethylamino)ethyl]phenoxy]propan-2-ol.
What is the SMILES notation for 1-[2-[1-(ethylamino)ethyl]phenoxy]propan-2-ol?
The canonical SMILES for 1-[2-[1-(ethylamino)ethyl]phenoxy]propan-2-ol is CCNC(C)c1ccccc1OCC(C)O.
What is the InChIKey of 1-[2-[1-(ethylamino)ethyl]phenoxy]propan-2-ol?
The InChIKey is DQCQTVJVPSEBKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO2/c1-4-14-11(3)12-7-5-6-8-13(12)16-9-10(2)15/h5-8,10-11,14-15H,4,9H2,1-3H3.
What are the key properties of 1-[2-[1-(ethylamino)ethyl]phenoxy]propan-2-ol?
1-[2-[1-(ethylamino)ethyl]phenoxy]propan-2-ol has a molecular weight of 223.32 g/mol, XLogP of 2.12, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[1-(ethylamino)ethyl]phenoxy]propan-2-ol is sourced from PubChem (CID 60882508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).