1-ethoxy-2-(quinolin-8-ylmethylamino)ethanol

C14H18N2O2 — CID 169240625

IUPAC1-ethoxy-2-(quinolin-8-ylmethylamino)ethanol
SMILESCCOC(O)CNCc1cccc2cccnc12
InChIInChI=1S/C14H18N2O2/c1-2-18-13(17)10-15-9-12-6-3-5-11-7-4-8-16-14(11)12/h3-8,13,15,17H,2,9-10H2,1H3
InChIKeyQHYKYAWLFADFLB-UHFFFAOYSA-N
MW246.31 g/mol
LogP1.68
Rot. Bonds6

About 1-ethoxy-2-(quinolin-8-ylmethylamino)ethanol

1-ethoxy-2-(quinolin-8-ylmethylamino)ethanol (PubChem CID 169240625) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 1-ethoxy-2-(quinolin-8-ylmethylamino)ethanol.

Molecular Properties

Compound Name1-ethoxy-2-(quinolin-8-ylmethylamino)ethanol
PubChem CID169240625
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name1-ethoxy-2-(quinolin-8-ylmethylamino)ethanol
SMILESCCOC(O)CNCc1cccc2cccnc12
InChIInChI=1S/C14H18N2O2/c1-2-18-13(17)10-15-9-12-6-3-5-11-7-4-8-16-14(11)12/h3-8,13,15,17H,2,9-10H2,1H3
InChIKeyQHYKYAWLFADFLB-UHFFFAOYSA-N
XLogP1.68
TPSA54.38 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-phenyl-2-(quinolin-8-ylmethylamino)ethanol
CID 43394632
3-methyl-4-(quinolin-8-ylmethylamino)butan-1-ol
CID 66089220
2-phenyl-N-(quinolin-8-ylmethyl)propan-1-amine
CID 43182084
N-(quinolin-8-ylmethyl)butan-1-amine
CID 28613793
1-(2-quinolin-8-ylethylamino)propan-2-ol
CID 81428765
1-pyrrolidin-1-yl-3-(quinolin-8-ylmethylamino)propan-2-ol
CID 78986962
1-cyclopentyl-3-(quinolin-8-ylmethylamino)propan-2-ol
CID 103158149
2,2-diethoxy-1-quinolin-8-ylethanol
CID 81220226
1-cyclobutyl-N-(quinolin-8-ylmethyl)methanamine
CID 43298300
ethyl 2-[2-(quinolin-8-ylmethylamino)ethoxy]acetate
CID 103258791
1-(2,3-dimethylphenyl)-N-(quinolin-8-ylmethyl)methanamine
CID 78980832
2-(quinolin-8-ylmethylamino)acetic acid
CID 43135065

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-2-(quinolin-8-ylmethylamino)ethanol?
The IUPAC name of 1-ethoxy-2-(quinolin-8-ylmethylamino)ethanol (CID 169240625) is 1-ethoxy-2-(quinolin-8-ylmethylamino)ethanol.
What is the SMILES notation for 1-ethoxy-2-(quinolin-8-ylmethylamino)ethanol?
The canonical SMILES for 1-ethoxy-2-(quinolin-8-ylmethylamino)ethanol is CCOC(O)CNCc1cccc2cccnc12.
What is the InChIKey of 1-ethoxy-2-(quinolin-8-ylmethylamino)ethanol?
The InChIKey is QHYKYAWLFADFLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-2-18-13(17)10-15-9-12-6-3-5-11-7-4-8-16-14(11)12/h3-8,13,15,17H,2,9-10H2,1H3.
What are the key properties of 1-ethoxy-2-(quinolin-8-ylmethylamino)ethanol?
1-ethoxy-2-(quinolin-8-ylmethylamino)ethanol has a molecular weight of 246.31 g/mol, XLogP of 1.68, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-2-(quinolin-8-ylmethylamino)ethanol is sourced from PubChem (CID 169240625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).