N-ethyl-2-(2-ethyl-4-propan-2-yloxyphenoxy)quinolin-6-amine

C22H26N2O2 — CID 68759452

IUPACN-ethyl-2-(2-ethyl-4-propan-2-yloxyphenoxy)quinolin-6-amine
SMILESCCNc1ccc2nc(Oc3ccc(OC(C)C)cc3CC)ccc2c1
InChIInChI=1S/C22H26N2O2/c1-5-16-14-19(25-15(3)4)9-11-21(16)26-22-12-7-17-13-18(23-6-2)8-10-20(17)24-22/h7-15,23H,5-6H2,1-4H3
InChIKeyJMVNJGFKPFJTNL-UHFFFAOYSA-N
MW350.46 g/mol
LogP5.81
Rot. Bonds7

About N-ethyl-2-(2-ethyl-4-propan-2-yloxyphenoxy)quinolin-6-amine

N-ethyl-2-(2-ethyl-4-propan-2-yloxyphenoxy)quinolin-6-amine (PubChem CID 68759452) has the molecular formula C22H26N2O2 and a molecular weight of 350.46 g/mol. Its IUPAC name is N-ethyl-2-(2-ethyl-4-propan-2-yloxyphenoxy)quinolin-6-amine.

Molecular Properties

Compound NameN-ethyl-2-(2-ethyl-4-propan-2-yloxyphenoxy)quinolin-6-amine
PubChem CID68759452
Molecular FormulaC22H26N2O2
Molecular Weight350.46 g/mol
Exact Mass350.20
IUPAC NameN-ethyl-2-(2-ethyl-4-propan-2-yloxyphenoxy)quinolin-6-amine
SMILESCCNc1ccc2nc(Oc3ccc(OC(C)C)cc3CC)ccc2c1
InChIInChI=1S/C22H26N2O2/c1-5-16-14-19(25-15(3)4)9-11-21(16)26-22-12-7-17-13-18(23-6-2)8-10-20(17)24-22/h7-15,23H,5-6H2,1-4H3
InChIKeyJMVNJGFKPFJTNL-UHFFFAOYSA-N
XLogP5.81
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500350.46
LogP ≤ 55.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-[4-(ethylamino)phenoxy]quinolin-6-yl]ethanone
CID 68760579
N-ethyl-2-(2-methyl-4-pyridin-2-yloxyphenoxy)quinolin-6-amine
CID 68760967
2-[3-chloro-4-(cyclopropylmethoxy)phenoxy]-N-ethylquinolin-6-amine
CID 68759944
N-ethyl-2-[3-(trifluoromethoxy)phenoxy]quinolin-6-amine
CID 68759601
2-[2-(4-butan-2-yloxy-2-methylphenoxy)quinolin-6-yl]acetaldehyde
CID 87563922
2-amino-N-[1-[2-(4-propan-2-yloxyphenoxy)quinolin-6-yl]ethyl]acetamide;hydrochloride
CID 68761041
1-[2-(3-chloro-4-propan-2-yloxyphenoxy)quinolin-6-yl]ethanone
CID 68759980
N-[2-[2-(3-methyl-4-propan-2-yloxyphenoxy)quinolin-6-yl]ethyl]acetamide
CID 68763349
2-[2-(3-chloro-4-propan-2-yloxyphenoxy)quinolin-6-yl]acetaldehyde
CID 87564191
2-[2-[(5-propan-2-yloxy-2-pyridinyl)oxy]quinolin-6-yl]acetaldehyde
CID 87564865
1-[4-(6-chloroquinolin-2-yl)oxyphenyl]-3-propan-2-ylurea
CID 126644832
N-ethyl-2-(4-propan-2-yloxyphenyl)pyridin-4-amine
CID 102824750

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(2-ethyl-4-propan-2-yloxyphenoxy)quinolin-6-amine?
The IUPAC name of N-ethyl-2-(2-ethyl-4-propan-2-yloxyphenoxy)quinolin-6-amine (CID 68759452) is N-ethyl-2-(2-ethyl-4-propan-2-yloxyphenoxy)quinolin-6-amine.
What is the SMILES notation for N-ethyl-2-(2-ethyl-4-propan-2-yloxyphenoxy)quinolin-6-amine?
The canonical SMILES for N-ethyl-2-(2-ethyl-4-propan-2-yloxyphenoxy)quinolin-6-amine is CCNc1ccc2nc(Oc3ccc(OC(C)C)cc3CC)ccc2c1.
What is the InChIKey of N-ethyl-2-(2-ethyl-4-propan-2-yloxyphenoxy)quinolin-6-amine?
The InChIKey is JMVNJGFKPFJTNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26N2O2/c1-5-16-14-19(25-15(3)4)9-11-21(16)26-22-12-7-17-13-18(23-6-2)8-10-20(17)24-22/h7-15,23H,5-6H2,1-4H3.
What are the key properties of N-ethyl-2-(2-ethyl-4-propan-2-yloxyphenoxy)quinolin-6-amine?
N-ethyl-2-(2-ethyl-4-propan-2-yloxyphenoxy)quinolin-6-amine has a molecular weight of 350.46 g/mol, XLogP of 5.81, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(2-ethyl-4-propan-2-yloxyphenoxy)quinolin-6-amine is sourced from PubChem (CID 68759452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).