6-ethoxy-3-phenylquinolin-2-amine;hydrochloride

C17H17ClN2O — CID 43866041

IUPAC6-ethoxy-3-phenylquinolin-2-amine;hydrochloride
SMILESCCOc1ccc2nc(N)c(-c3ccccc3)cc2c1.Cl
InChIInChI=1S/C17H16N2O.ClH/c1-2-20-14-8-9-16-13(10-14)11-15(17(18)19-16)12-6-4-3-5-7-12;/h3-11H,2H2,1H3,(H2,18,19);1H
InChIKeyGFRDLJZVNOOIPB-UHFFFAOYSA-N
MW300.79 g/mol
LogP4.30
Rot. Bonds3

About 6-ethoxy-3-phenylquinolin-2-amine;hydrochloride

6-ethoxy-3-phenylquinolin-2-amine;hydrochloride (PubChem CID 43866041) has the molecular formula C17H17ClN2O and a molecular weight of 300.79 g/mol. Its IUPAC name is 6-ethoxy-3-phenylquinolin-2-amine;hydrochloride.

Molecular Properties

Compound Name6-ethoxy-3-phenylquinolin-2-amine;hydrochloride
PubChem CID43866041
Molecular FormulaC17H17ClN2O
Molecular Weight300.79 g/mol
Exact Mass300.10
IUPAC Name6-ethoxy-3-phenylquinolin-2-amine;hydrochloride
SMILESCCOc1ccc2nc(N)c(-c3ccccc3)cc2c1.Cl
InChIInChI=1S/C17H16N2O.ClH/c1-2-20-14-8-9-16-13(10-14)11-15(17(18)19-16)12-6-4-3-5-7-12;/h3-11H,2H2,1H3,(H2,18,19);1H
InChIKeyGFRDLJZVNOOIPB-UHFFFAOYSA-N
XLogP4.30
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.79
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-phenylquinolin-2-amine;hydrochloride
CID 43865994
2,4-diethoxy-1-phenylbenzene
CID 132889855
4-ethoxy-1-iodo-2-phenylbenzene
CID 156900261
2-ethoxynaphthalene
CID 118978197
3-(2-ethoxy-6-methoxyquinolin-3-yl)-5-phenyl-1,2,4-oxadiazole
CID 4318522
4-chloro-6-ethoxy-3-methyl-2-phenylquinoline
CID 104845970
6-ethoxy-3-fluoroquinoline
CID 90101959
3-phenyl-6-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)quinolin-2-amine
CID 66800865
3-(3-ethoxyphenoxy)quinoxalin-2-amine
CID 102988134
6-ethoxy-2-methylquinoline-3-carboxylic acid
CID 17039997
6-ethoxyisoquinolin-1-amine
CID 82062973
2-(3-ethoxyphenyl)aniline
CID 57482711

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-3-phenylquinolin-2-amine;hydrochloride?
The IUPAC name of 6-ethoxy-3-phenylquinolin-2-amine;hydrochloride (CID 43866041) is 6-ethoxy-3-phenylquinolin-2-amine;hydrochloride.
What is the SMILES notation for 6-ethoxy-3-phenylquinolin-2-amine;hydrochloride?
The canonical SMILES for 6-ethoxy-3-phenylquinolin-2-amine;hydrochloride is CCOc1ccc2nc(N)c(-c3ccccc3)cc2c1.Cl.
What is the InChIKey of 6-ethoxy-3-phenylquinolin-2-amine;hydrochloride?
The InChIKey is GFRDLJZVNOOIPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O.ClH/c1-2-20-14-8-9-16-13(10-14)11-15(17(18)19-16)12-6-4-3-5-7-12;/h3-11H,2H2,1H3,(H2,18,19);1H.
What are the key properties of 6-ethoxy-3-phenylquinolin-2-amine;hydrochloride?
6-ethoxy-3-phenylquinolin-2-amine;hydrochloride has a molecular weight of 300.79 g/mol, XLogP of 4.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-3-phenylquinolin-2-amine;hydrochloride is sourced from PubChem (CID 43866041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).