2-[(5-chloroquinolin-8-yl)methyl-ethylamino]ethanol

C14H17ClN2O — CID 60509838

IUPAC2-[(5-chloroquinolin-8-yl)methyl-ethylamino]ethanol
SMILESCCN(CCO)Cc1ccc(Cl)c2cccnc12
InChIInChI=1S/C14H17ClN2O/c1-2-17(8-9-18)10-11-5-6-13(15)12-4-3-7-16-14(11)12/h3-7,18H,2,8-10H2,1H3
InChIKeyOFQPFCSPOVWUKV-UHFFFAOYSA-N
MW264.76 g/mol
LogP2.70
Rot. Bonds5

About 2-[(5-chloroquinolin-8-yl)methyl-ethylamino]ethanol

2-[(5-chloroquinolin-8-yl)methyl-ethylamino]ethanol (PubChem CID 60509838) has the molecular formula C14H17ClN2O and a molecular weight of 264.76 g/mol. Its IUPAC name is 2-[(5-chloroquinolin-8-yl)methyl-ethylamino]ethanol.

Molecular Properties

Compound Name2-[(5-chloroquinolin-8-yl)methyl-ethylamino]ethanol
PubChem CID60509838
Molecular FormulaC14H17ClN2O
Molecular Weight264.76 g/mol
Exact Mass264.10
IUPAC Name2-[(5-chloroquinolin-8-yl)methyl-ethylamino]ethanol
SMILESCCN(CCO)Cc1ccc(Cl)c2cccnc12
InChIInChI=1S/C14H17ClN2O/c1-2-17(8-9-18)10-11-5-6-13(15)12-4-3-7-16-14(11)12/h3-7,18H,2,8-10H2,1H3
InChIKeyOFQPFCSPOVWUKV-UHFFFAOYSA-N
XLogP2.70
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.76
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(2-amino-3-pyridinyl)methyl-ethylamino]ethanol
CID 62472272
4-[(5-chloroquinolin-8-yl)methyl-cyclopropylamino]butan-1-ol
CID 111431912
2-(5-chloroquinolin-8-yl)oxy-N,N-diethylethanamine
CID 146013303
2-[(2-chloro-3-pyridinyl)methyl-propylamino]ethanol
CID 62470914
3-[(5-chloroquinolin-8-yl)methylamino]-3-methylpentan-1-ol
CID 103774861
methyl 2-[(5-chloroquinolin-8-yl)methyl-[(3,5-dimethoxyphenyl)methyl]amino]acetate
CID 60585076
2-[butyl-[(2-chloro-3-pyridinyl)methyl]amino]ethanol
CID 62469822
1-(5-chloroquinolin-8-yl)-N-ethoxymethanamine
CID 112686388
8-[[ethyl(2-methylpropyl)amino]methyl]quinolin-5-amine
CID 43375996
N-[(2-chloro-3-pyridinyl)methyl]-N-ethylpropan-1-amine
CID 62470730
(5-chloroquinolin-8-yl)methylhydrazine
CID 112617928
8-[(dibutylamino)methyl]quinolin-5-amine
CID 43375839

Frequently Asked Questions

What is the IUPAC name of 2-[(5-chloroquinolin-8-yl)methyl-ethylamino]ethanol?
The IUPAC name of 2-[(5-chloroquinolin-8-yl)methyl-ethylamino]ethanol (CID 60509838) is 2-[(5-chloroquinolin-8-yl)methyl-ethylamino]ethanol.
What is the SMILES notation for 2-[(5-chloroquinolin-8-yl)methyl-ethylamino]ethanol?
The canonical SMILES for 2-[(5-chloroquinolin-8-yl)methyl-ethylamino]ethanol is CCN(CCO)Cc1ccc(Cl)c2cccnc12.
What is the InChIKey of 2-[(5-chloroquinolin-8-yl)methyl-ethylamino]ethanol?
The InChIKey is OFQPFCSPOVWUKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17ClN2O/c1-2-17(8-9-18)10-11-5-6-13(15)12-4-3-7-16-14(11)12/h3-7,18H,2,8-10H2,1H3.
What are the key properties of 2-[(5-chloroquinolin-8-yl)methyl-ethylamino]ethanol?
2-[(5-chloroquinolin-8-yl)methyl-ethylamino]ethanol has a molecular weight of 264.76 g/mol, XLogP of 2.70, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-chloroquinolin-8-yl)methyl-ethylamino]ethanol is sourced from PubChem (CID 60509838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).