2-[ethyl-[2-(4-propoxyphenoxy)ethyl]amino]ethanol

C15H25NO3 — CID 60685463

IUPAC2-[ethyl-[2-(4-propoxyphenoxy)ethyl]amino]ethanol
SMILESCCCOc1ccc(OCCN(CC)CCO)cc1
InChIInChI=1S/C15H25NO3/c1-3-12-18-14-5-7-15(8-6-14)19-13-10-16(4-2)9-11-17/h5-8,17H,3-4,9-13H2,1-2H3
InChIKeySPOIZLADFYQIEW-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.17
Rot. Bonds10

About 2-[ethyl-[2-(4-propoxyphenoxy)ethyl]amino]ethanol

2-[ethyl-[2-(4-propoxyphenoxy)ethyl]amino]ethanol (PubChem CID 60685463) has the molecular formula C15H25NO3 and a molecular weight of 267.37 g/mol. Its IUPAC name is 2-[ethyl-[2-(4-propoxyphenoxy)ethyl]amino]ethanol.

Molecular Properties

Compound Name2-[ethyl-[2-(4-propoxyphenoxy)ethyl]amino]ethanol
PubChem CID60685463
Molecular FormulaC15H25NO3
Molecular Weight267.37 g/mol
Exact Mass267.18
IUPAC Name2-[ethyl-[2-(4-propoxyphenoxy)ethyl]amino]ethanol
SMILESCCCOc1ccc(OCCN(CC)CCO)cc1
InChIInChI=1S/C15H25NO3/c1-3-12-18-14-5-7-15(8-6-14)19-13-10-16(4-2)9-11-17/h5-8,17H,3-4,9-13H2,1-2H3
InChIKeySPOIZLADFYQIEW-UHFFFAOYSA-N
XLogP2.17
TPSA41.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[2-[ethyl(2-hydroxyethyl)amino]ethoxy]phenyl]ethanethioamide
CID 54879731
2-[3-(4-chlorophenoxy)propyl-ethylamino]ethanol
CID 60685925
2-[4-[(E)-3-[4-[2-(diethylamino)ethoxy]phenyl]but-2-en-2-yl]phenoxy]-N,N-diethylethanamine
CID 3038049
4-[2-[ethyl(propyl)amino]ethoxy]benzenecarbothioamide
CID 43290637
N,N-diethyl-2-(4-fluorophenoxy)ethanamine
CID 867210
[4-[3-[ethyl(2-hydroxyethyl)amino]propoxy]phenyl]-phenylmethanone
CID 58184911
3-[3-(4-chlorophenoxy)propyl-ethylamino]propan-1-ol
CID 115666232
5-(4-propoxyphenoxy)pentan-1-ol
CID 62227500
4-[2-[ethyl(propyl)amino]ethoxy]benzohydrazide
CID 55213633
3-(diethylamino)-1-(4-propoxyphenyl)propan-1-one
CID 3056738
N-ethyl-N-[2-[4-(methylaminomethyl)phenoxy]ethyl]propan-1-amine
CID 55074636
4-[2-(diethylamino)ethoxy]benzenecarbothioamide
CID 20987052

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[2-(4-propoxyphenoxy)ethyl]amino]ethanol?
The IUPAC name of 2-[ethyl-[2-(4-propoxyphenoxy)ethyl]amino]ethanol (CID 60685463) is 2-[ethyl-[2-(4-propoxyphenoxy)ethyl]amino]ethanol.
What is the SMILES notation for 2-[ethyl-[2-(4-propoxyphenoxy)ethyl]amino]ethanol?
The canonical SMILES for 2-[ethyl-[2-(4-propoxyphenoxy)ethyl]amino]ethanol is CCCOc1ccc(OCCN(CC)CCO)cc1.
What is the InChIKey of 2-[ethyl-[2-(4-propoxyphenoxy)ethyl]amino]ethanol?
The InChIKey is SPOIZLADFYQIEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO3/c1-3-12-18-14-5-7-15(8-6-14)19-13-10-16(4-2)9-11-17/h5-8,17H,3-4,9-13H2,1-2H3.
What are the key properties of 2-[ethyl-[2-(4-propoxyphenoxy)ethyl]amino]ethanol?
2-[ethyl-[2-(4-propoxyphenoxy)ethyl]amino]ethanol has a molecular weight of 267.37 g/mol, XLogP of 2.17, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[2-(4-propoxyphenoxy)ethyl]amino]ethanol is sourced from PubChem (CID 60685463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).