3-[[ethyl(2-methoxyethyl)amino]methyl]-7-methoxyquinolin-2-amine

C16H23N3O2 — CID 62208238

IUPAC3-[[ethyl(2-methoxyethyl)amino]methyl]-7-methoxyquinolin-2-amine
SMILESCCN(CCOC)Cc1cc2ccc(OC)cc2nc1N
InChIInChI=1S/C16H23N3O2/c1-4-19(7-8-20-2)11-13-9-12-5-6-14(21-3)10-15(12)18-16(13)17/h5-6,9-10H,4,7-8,11H2,1-3H3,(H2,17,18)
InChIKeyMKCKMRCKEYTFES-UHFFFAOYSA-N
MW289.38 g/mol
LogP2.29
Rot. Bonds7

About 3-[[ethyl(2-methoxyethyl)amino]methyl]-7-methoxyquinolin-2-amine

3-[[ethyl(2-methoxyethyl)amino]methyl]-7-methoxyquinolin-2-amine (PubChem CID 62208238) has the molecular formula C16H23N3O2 and a molecular weight of 289.38 g/mol. Its IUPAC name is 3-[[ethyl(2-methoxyethyl)amino]methyl]-7-methoxyquinolin-2-amine.

Molecular Properties

Compound Name3-[[ethyl(2-methoxyethyl)amino]methyl]-7-methoxyquinolin-2-amine
PubChem CID62208238
Molecular FormulaC16H23N3O2
Molecular Weight289.38 g/mol
Exact Mass289.18
IUPAC Name3-[[ethyl(2-methoxyethyl)amino]methyl]-7-methoxyquinolin-2-amine
SMILESCCN(CCOC)Cc1cc2ccc(OC)cc2nc1N
InChIInChI=1S/C16H23N3O2/c1-4-19(7-8-20-2)11-13-9-12-5-6-14(21-3)10-15(12)18-16(13)17/h5-6,9-10H,4,7-8,11H2,1-3H3,(H2,17,18)
InChIKeyMKCKMRCKEYTFES-UHFFFAOYSA-N
XLogP2.29
TPSA60.61 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(2-amino-7-methoxyquinolin-3-yl)methyl-ethylamino]propanenitrile
CID 62208226
N-[(2-chloro-7-methoxyquinolin-3-yl)methyl]-N-ethylpropan-1-amine
CID 60921581
(2-amino-7-methoxyquinolin-3-yl)methanol
CID 62194670
N-ethyl-N-[(2-hydrazinyl-7-methoxyquinolin-3-yl)methyl]ethanamine
CID 62244421
3-(butoxymethyl)-7-methoxyquinolin-2-amine
CID 55044888
N-ethyl-2-methoxy-N-[(4-methoxyphenyl)methyl]ethanamine
CID 51086801
N-[(2-chloroquinolin-3-yl)methyl]-N-ethyl-2-methoxyethanamine
CID 61447959
4-[[ethyl(2-methoxyethyl)amino]methyl]-3-methoxyaniline
CID 107208306
3-bromo-7-methoxyquinolin-2-amine
CID 126637777
3-[[butan-2-yl(2-methoxyethyl)amino]methyl]quinolin-2-amine
CID 62209123
N-[(2-bromo-5-methoxyphenyl)methyl]-2-ethoxy-N-ethylethanamine
CID 65325974
N-[(2-bromo-5-methoxyphenyl)methyl]-N-(2-chloroethyl)-2-methoxyethanamine
CID 113468132

Frequently Asked Questions

What is the IUPAC name of 3-[[ethyl(2-methoxyethyl)amino]methyl]-7-methoxyquinolin-2-amine?
The IUPAC name of 3-[[ethyl(2-methoxyethyl)amino]methyl]-7-methoxyquinolin-2-amine (CID 62208238) is 3-[[ethyl(2-methoxyethyl)amino]methyl]-7-methoxyquinolin-2-amine.
What is the SMILES notation for 3-[[ethyl(2-methoxyethyl)amino]methyl]-7-methoxyquinolin-2-amine?
The canonical SMILES for 3-[[ethyl(2-methoxyethyl)amino]methyl]-7-methoxyquinolin-2-amine is CCN(CCOC)Cc1cc2ccc(OC)cc2nc1N.
What is the InChIKey of 3-[[ethyl(2-methoxyethyl)amino]methyl]-7-methoxyquinolin-2-amine?
The InChIKey is MKCKMRCKEYTFES-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N3O2/c1-4-19(7-8-20-2)11-13-9-12-5-6-14(21-3)10-15(12)18-16(13)17/h5-6,9-10H,4,7-8,11H2,1-3H3,(H2,17,18).
What are the key properties of 3-[[ethyl(2-methoxyethyl)amino]methyl]-7-methoxyquinolin-2-amine?
3-[[ethyl(2-methoxyethyl)amino]methyl]-7-methoxyquinolin-2-amine has a molecular weight of 289.38 g/mol, XLogP of 2.29, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[ethyl(2-methoxyethyl)amino]methyl]-7-methoxyquinolin-2-amine is sourced from PubChem (CID 62208238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).