N-(3-ethylpentan-2-yl)quinolin-2-amine

C16H22N2 — CID 55260765

IUPACN-(3-ethylpentan-2-yl)quinolin-2-amine
SMILESCCC(CC)C(C)Nc1ccc2ccccc2n1
InChIInChI=1S/C16H22N2/c1-4-13(5-2)12(3)17-16-11-10-14-8-6-7-9-15(14)18-16/h6-13H,4-5H2,1-3H3,(H,17,18)
InChIKeyAJPKMBDMUOSHEV-UHFFFAOYSA-N
MW242.37 g/mol
LogP4.47
Rot. Bonds5

About N-(3-ethylpentan-2-yl)quinolin-2-amine

N-(3-ethylpentan-2-yl)quinolin-2-amine (PubChem CID 55260765) has the molecular formula C16H22N2 and a molecular weight of 242.37 g/mol. Its IUPAC name is N-(3-ethylpentan-2-yl)quinolin-2-amine.

Molecular Properties

Compound NameN-(3-ethylpentan-2-yl)quinolin-2-amine
PubChem CID55260765
Molecular FormulaC16H22N2
Molecular Weight242.37 g/mol
Exact Mass242.18
IUPAC NameN-(3-ethylpentan-2-yl)quinolin-2-amine
SMILESCCC(CC)C(C)Nc1ccc2ccccc2n1
InChIInChI=1S/C16H22N2/c1-4-13(5-2)12(3)17-16-11-10-14-8-6-7-9-15(14)18-16/h6-13H,4-5H2,1-3H3,(H,17,18)
InChIKeyAJPKMBDMUOSHEV-UHFFFAOYSA-N
XLogP4.47
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(3-ethylpentan-2-yl)quinolin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3-ethylpentan-2-yl)-6-nitroquinolin-2-amine
CID 63839044
4-N-quinolin-2-ylpentane-2,4-diamine
CID 113376889
N-[bis(phosphanyl)methyl]quinolin-2-amine
CID 118465830
N-(1-pyrazol-1-ylpropan-2-yl)quinolin-2-amine
CID 61462720
(4S)-1-N,1-N-diethyl-4-N-quinolin-2-ylpentane-1,4-diamine
CID 36691119
N-(4-methylsulfinylbutan-2-yl)quinolin-2-amine
CID 113260886
N-[1-(4-fluorophenyl)propan-2-yl]quinolin-2-amine
CID 63541693
N-[1-(4-chlorophenyl)ethyl]quinolin-2-amine
CID 60644870
N-[1-(5-methylfuran-2-yl)ethyl]quinolin-2-amine
CID 60651617
1-N-quinolin-2-ylbutane-1,3-diamine
CID 63251635
methyl 3-hydroxy-2-(quinolin-2-ylamino)propanoate
CID 62006992
4,4-dimethyl-3-(quinolin-2-ylamino)pentan-1-ol
CID 106350849

Frequently Asked Questions

What is the IUPAC name of N-(3-ethylpentan-2-yl)quinolin-2-amine?
The IUPAC name of N-(3-ethylpentan-2-yl)quinolin-2-amine (CID 55260765) is N-(3-ethylpentan-2-yl)quinolin-2-amine.
What is the SMILES notation for N-(3-ethylpentan-2-yl)quinolin-2-amine?
The canonical SMILES for N-(3-ethylpentan-2-yl)quinolin-2-amine is CCC(CC)C(C)Nc1ccc2ccccc2n1.
What is the InChIKey of N-(3-ethylpentan-2-yl)quinolin-2-amine?
The InChIKey is AJPKMBDMUOSHEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2/c1-4-13(5-2)12(3)17-16-11-10-14-8-6-7-9-15(14)18-16/h6-13H,4-5H2,1-3H3,(H,17,18).
What are the key properties of N-(3-ethylpentan-2-yl)quinolin-2-amine?
N-(3-ethylpentan-2-yl)quinolin-2-amine has a molecular weight of 242.37 g/mol, XLogP of 4.47, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethylpentan-2-yl)quinolin-2-amine is sourced from PubChem (CID 55260765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).