2-(3-methoxyquinolin-4-yl)ethanamine

C12H14N2O — CID 84670749

IUPAC2-(3-methoxyquinolin-4-yl)ethanamine
SMILESCOc1cnc2ccccc2c1CCN
InChIInChI=1S/C12H14N2O/c1-15-12-8-14-11-5-3-2-4-9(11)10(12)6-7-13/h2-5,8H,6-7,13H2,1H3
InChIKeySMBNDFCIFBUEHP-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.74
Rot. Bonds3

About 2-(3-methoxyquinolin-4-yl)ethanamine

2-(3-methoxyquinolin-4-yl)ethanamine (PubChem CID 84670749) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 2-(3-methoxyquinolin-4-yl)ethanamine.

Molecular Properties

Compound Name2-(3-methoxyquinolin-4-yl)ethanamine
PubChem CID84670749
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name2-(3-methoxyquinolin-4-yl)ethanamine
SMILESCOc1cnc2ccccc2c1CCN
InChIInChI=1S/C12H14N2O/c1-15-12-8-14-11-5-3-2-4-9(11)10(12)6-7-13/h2-5,8H,6-7,13H2,1H3
InChIKeySMBNDFCIFBUEHP-UHFFFAOYSA-N
XLogP1.74
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[4-(2-methoxyphenoxy)quinolin-3-yl]methanamine
CID 43669445
2-(3,5-dimethoxy-4-pyridinyl)ethanamine
CID 82654852
2-(4-methoxynaphthalen-1-yl)ethanamine
CID 1251790
[4-(2-methoxyphenyl)sulfanylquinolin-3-yl]methanamine
CID 61290357
2-(6-methoxy-2-methylquinolin-5-yl)ethanamine
CID 82575506
2-(2,3-dimethoxy-5-quinolin-3-ylphenyl)ethanamine
CID 39226750
N,N-diethyl-3-methoxyquinoline-4-carboxamide
CID 110855209
4-(3-aminoquinolin-4-yl)-2-methylbutan-2-ol;ethane
CID 123547885
(4-propan-2-yloxyquinolin-3-yl)methanamine
CID 43669459
2-(2-methylacridin-9-yl)ethanamine
CID 170887950
4-butyl-3-methylquinoline
CID 153439340
2-(7-methoxyimidazo[2,1-a]isoquinolin-3-yl)ethanamine
CID 115044237

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyquinolin-4-yl)ethanamine?
The IUPAC name of 2-(3-methoxyquinolin-4-yl)ethanamine (CID 84670749) is 2-(3-methoxyquinolin-4-yl)ethanamine.
What is the SMILES notation for 2-(3-methoxyquinolin-4-yl)ethanamine?
The canonical SMILES for 2-(3-methoxyquinolin-4-yl)ethanamine is COc1cnc2ccccc2c1CCN.
What is the InChIKey of 2-(3-methoxyquinolin-4-yl)ethanamine?
The InChIKey is SMBNDFCIFBUEHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-15-12-8-14-11-5-3-2-4-9(11)10(12)6-7-13/h2-5,8H,6-7,13H2,1H3.
What are the key properties of 2-(3-methoxyquinolin-4-yl)ethanamine?
2-(3-methoxyquinolin-4-yl)ethanamine has a molecular weight of 202.26 g/mol, XLogP of 1.74, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyquinolin-4-yl)ethanamine is sourced from PubChem (CID 84670749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).