N-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine

C16H22N2O — CID 43146991

IUPACN-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine
SMILESCOC(C)(C)CC(C)Nc1cccc2cccnc12
InChIInChI=1S/C16H22N2O/c1-12(11-16(2,3)19-4)18-14-9-5-7-13-8-6-10-17-15(13)14/h5-10,12,18H,11H2,1-4H3
InChIKeyPWSXIPBFYOEHJL-UHFFFAOYSA-N
MW258.36 g/mol
LogP3.85
Rot. Bonds5

About N-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine

N-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine (PubChem CID 43146991) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is N-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine.

Molecular Properties

Compound NameN-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine
PubChem CID43146991
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC NameN-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine
SMILESCOC(C)(C)CC(C)Nc1cccc2cccnc12
InChIInChI=1S/C16H22N2O/c1-12(11-16(2,3)19-4)18-14-9-5-7-13-8-6-10-17-15(13)14/h5-10,12,18H,11H2,1-4H3
InChIKeyPWSXIPBFYOEHJL-UHFFFAOYSA-N
XLogP3.85
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methylpentan-2-yl)quinolin-8-amine
CID 43097667
N-(3-methoxy-3-methylbutyl)quinolin-8-amine
CID 106675039
N-(4-phenylbutan-2-yl)quinolin-8-amine
CID 43098678
N-(4-methoxy-4-methylpentan-2-yl)-2-(2-methylimidazol-1-yl)pyridin-3-amine
CID 60943379
N-[1-(4-methoxyphenyl)ethyl]quinolin-8-amine
CID 43191660
N-methoxyquinolin-8-amine
CID 143696561
2-ethyl-N-(4-methoxy-4-methylpentan-2-yl)aniline
CID 43147091
N-(1-cyclopropylethyl)quinolin-8-amine
CID 43191657
N-(3,3-dimethylbutyl)quinolin-8-amine
CID 62965994
N-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine
CID 79549224
N-(4-methoxy-4-methylpentan-2-yl)-2-(trifluoromethylsulfanyl)aniline
CID 43676612
N-[1-(2-methylphenyl)ethyl]quinolin-8-amine
CID 43191669

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine?
The IUPAC name of N-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine (CID 43146991) is N-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine.
What is the SMILES notation for N-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine?
The canonical SMILES for N-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine is COC(C)(C)CC(C)Nc1cccc2cccnc12.
What is the InChIKey of N-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine?
The InChIKey is PWSXIPBFYOEHJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-12(11-16(2,3)19-4)18-14-9-5-7-13-8-6-10-17-15(13)14/h5-10,12,18H,11H2,1-4H3.
What are the key properties of N-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine?
N-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine has a molecular weight of 258.36 g/mol, XLogP of 3.85, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxy-4-methylpentan-2-yl)quinolin-8-amine is sourced from PubChem (CID 43146991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).