4-[1-[2-ethoxyethyl(ethyl)amino]ethyl]phenol

C14H23NO2 — CID 82980754

IUPAC4-[1-[2-ethoxyethyl(ethyl)amino]ethyl]phenol
SMILESCCOCCN(CC)C(C)c1ccc(O)cc1
InChIInChI=1S/C14H23NO2/c1-4-15(10-11-17-5-2)12(3)13-6-8-14(16)9-7-13/h6-9,12,16H,4-5,10-11H2,1-3H3
InChIKeyMSJGQLAMKPSPKH-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.81
Rot. Bonds7

About 4-[1-[2-ethoxyethyl(ethyl)amino]ethyl]phenol

4-[1-[2-ethoxyethyl(ethyl)amino]ethyl]phenol (PubChem CID 82980754) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 4-[1-[2-ethoxyethyl(ethyl)amino]ethyl]phenol.

Molecular Properties

Compound Name4-[1-[2-ethoxyethyl(ethyl)amino]ethyl]phenol
PubChem CID82980754
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name4-[1-[2-ethoxyethyl(ethyl)amino]ethyl]phenol
SMILESCCOCCN(CC)C(C)c1ccc(O)cc1
InChIInChI=1S/C14H23NO2/c1-4-15(10-11-17-5-2)12(3)13-6-8-14(16)9-7-13/h6-9,12,16H,4-5,10-11H2,1-3H3
InChIKeyMSJGQLAMKPSPKH-UHFFFAOYSA-N
XLogP2.81
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-bromo-2-[1-[2-ethoxyethyl(ethyl)amino]ethyl]phenol
CID 82981118
4-[1-[2-methoxyethyl(propan-2-yl)amino]ethyl]phenol
CID 82982782
4-(1-ethoxypropan-2-yl)phenol
CID 91168138
3-N-(2-ethoxyethyl)-3-N-ethylbutane-1,3-diamine
CID 63698411
1-(4-chlorophenyl)-1-N-(2-ethoxyethyl)-1-N-ethylbutane-1,2-diamine
CID 63696821
4-[1-[1-methoxypropan-2-yl(methyl)amino]ethyl]phenol
CID 82982525
1-N,1-N-bis(2-ethoxyethyl)-1-phenylpropane-1,2-diamine
CID 82960381
4-[3-ethoxypropyl(ethyl)amino]phenol
CID 57229004
1-N,1-N-bis(2-ethoxyethyl)-1-pyridin-4-ylpropane-1,2-diamine
CID 82960632
4-(5-ethoxy-2-methylpentyl)phenol
CID 174733302
2-[1-[ethyl(2-methoxyethyl)amino]ethyl]phenol
CID 82979119
1-[4-[2-ethoxyethyl(methyl)amino]phenyl]ethanol
CID 81057167

Frequently Asked Questions

What is the IUPAC name of 4-[1-[2-ethoxyethyl(ethyl)amino]ethyl]phenol?
The IUPAC name of 4-[1-[2-ethoxyethyl(ethyl)amino]ethyl]phenol (CID 82980754) is 4-[1-[2-ethoxyethyl(ethyl)amino]ethyl]phenol.
What is the SMILES notation for 4-[1-[2-ethoxyethyl(ethyl)amino]ethyl]phenol?
The canonical SMILES for 4-[1-[2-ethoxyethyl(ethyl)amino]ethyl]phenol is CCOCCN(CC)C(C)c1ccc(O)cc1.
What is the InChIKey of 4-[1-[2-ethoxyethyl(ethyl)amino]ethyl]phenol?
The InChIKey is MSJGQLAMKPSPKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-4-15(10-11-17-5-2)12(3)13-6-8-14(16)9-7-13/h6-9,12,16H,4-5,10-11H2,1-3H3.
What are the key properties of 4-[1-[2-ethoxyethyl(ethyl)amino]ethyl]phenol?
4-[1-[2-ethoxyethyl(ethyl)amino]ethyl]phenol has a molecular weight of 237.34 g/mol, XLogP of 2.81, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[2-ethoxyethyl(ethyl)amino]ethyl]phenol is sourced from PubChem (CID 82980754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).