N-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine

C15H19ClN2O — CID 91774737

IUPACN-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine
SMILESCCN(CCOC)Cc1ccc2cc(Cl)ccc2n1
InChIInChI=1S/C15H19ClN2O/c1-3-18(8-9-19-2)11-14-6-4-12-10-13(16)5-7-15(12)17-14/h4-7,10H,3,8-9,11H2,1-2H3
InChIKeyLJTXQRWYOKMPTP-UHFFFAOYSA-N
MW278.78 g/mol
LogP3.36
Rot. Bonds6

About N-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine

N-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine (PubChem CID 91774737) has the molecular formula C15H19ClN2O and a molecular weight of 278.78 g/mol. Its IUPAC name is N-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine.

Molecular Properties

Compound NameN-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine
PubChem CID91774737
Molecular FormulaC15H19ClN2O
Molecular Weight278.78 g/mol
Exact Mass278.12
IUPAC NameN-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine
SMILESCCN(CCOC)Cc1ccc2cc(Cl)ccc2n1
InChIInChI=1S/C15H19ClN2O/c1-3-18(8-9-19-2)11-14-6-4-12-10-13(16)5-7-15(12)17-14/h4-7,10H,3,8-9,11H2,1-2H3
InChIKeyLJTXQRWYOKMPTP-UHFFFAOYSA-N
XLogP3.36
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.78
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine with MolForge

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Related Compounds

N-[(2-chloroquinolin-3-yl)methyl]-N-ethyl-2-methoxyethanamine
CID 61447959
N-[(5-chloropyrazin-2-yl)methyl]-N-ethyl-2-methoxyethanamine
CID 103054155
N,N'-diethyl-N,N'-bis(quinolin-2-ylmethyl)ethane-1,2-diamine
CID 101381014
6-chloro-2-(fluoromethyl)quinoline
CID 162400997
6-chloro-2-[[(1R,5S)-8-methoxy-3-azabicyclo[3.2.1]octan-3-yl]methyl]quinoline
CID 74247744
methyl 4-[7-chloro-4-[[ethyl(2-methoxyethyl)amino]methyl]quinolin-2-yl]benzoate
CID 171492180
3-[[ethyl(2-methoxyethyl)amino]methyl]-7-methoxyquinolin-2-amine
CID 62208238
3-[(6-chloroquinolin-2-yl)methyl-methylamino]propane-1,2-diol
CID 77080268
N-[(5-chloro-1-methylbenzimidazol-2-yl)methyl]-2-methoxy-N-(2-methoxyethyl)ethanamine
CID 78899266
(2S)-3-[(6-chloroquinolin-2-yl)methyl-methylamino]propane-1,2-diol
CID 99928103
N-[[4-(chloromethyl)-1,3-thiazol-2-yl]methyl]-N-ethyl-2-methoxyethanamine
CID 61446641
N-ethyl-N-[(5-ethynyl-2-pyridinyl)methyl]-2-methoxyethanamine
CID 89197233

Frequently Asked Questions

What is the IUPAC name of N-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine?
The IUPAC name of N-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine (CID 91774737) is N-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine.
What is the SMILES notation for N-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine?
The canonical SMILES for N-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine is CCN(CCOC)Cc1ccc2cc(Cl)ccc2n1.
What is the InChIKey of N-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine?
The InChIKey is LJTXQRWYOKMPTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O/c1-3-18(8-9-19-2)11-14-6-4-12-10-13(16)5-7-15(12)17-14/h4-7,10H,3,8-9,11H2,1-2H3.
What are the key properties of N-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine?
N-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine has a molecular weight of 278.78 g/mol, XLogP of 3.36, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-chloroquinolin-2-yl)methyl]-N-ethyl-2-methoxyethanamine is sourced from PubChem (CID 91774737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).