N-ethyl-2,2-dimethyl-1-quinolin-8-ylbutan-1-amine

C17H24N2 — CID 105021242

IUPACN-ethyl-2,2-dimethyl-1-quinolin-8-ylbutan-1-amine
SMILESCCNC(c1cccc2cccnc12)C(C)(C)CC
InChIInChI=1S/C17H24N2/c1-5-17(3,4)16(18-6-2)14-11-7-9-13-10-8-12-19-15(13)14/h7-12,16,18H,5-6H2,1-4H3
InChIKeyLRPDSQXEZKMCFA-UHFFFAOYSA-N
MW256.39 g/mol
LogP4.32
Rot. Bonds5

About N-ethyl-2,2-dimethyl-1-quinolin-8-ylbutan-1-amine

N-ethyl-2,2-dimethyl-1-quinolin-8-ylbutan-1-amine (PubChem CID 105021242) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is N-ethyl-2,2-dimethyl-1-quinolin-8-ylbutan-1-amine.

Molecular Properties

Compound NameN-ethyl-2,2-dimethyl-1-quinolin-8-ylbutan-1-amine
PubChem CID105021242
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC NameN-ethyl-2,2-dimethyl-1-quinolin-8-ylbutan-1-amine
SMILESCCNC(c1cccc2cccnc12)C(C)(C)CC
InChIInChI=1S/C17H24N2/c1-5-17(3,4)16(18-6-2)14-11-7-9-13-10-8-12-19-15(13)14/h7-12,16,18H,5-6H2,1-4H3
InChIKeyLRPDSQXEZKMCFA-UHFFFAOYSA-N
XLogP4.32
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 54.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethoxy-2-ethyl-N-methyl-1-quinolin-8-ylbutan-1-amine
CID 116759944
N-[1H-imidazol-2-yl(quinolin-8-yl)methyl]ethanamine
CID 81231091
N-ethyl-3-methyl-1-quinolin-8-ylbut-3-en-1-amine
CID 105163061
N-[(5-iodothiophen-3-yl)-quinolin-8-ylmethyl]ethanamine
CID 105021278
N-[6-bicyclo[3.1.0]hexanyl(quinolin-8-yl)methyl]ethanamine
CID 105021311
2-(diethylamino)-2-methyl-1-quinolin-8-ylbutan-1-ol
CID 81209930
ethyl 3-(ethylamino)-3-quinolin-8-ylpropanoate
CID 65234270
N,2-dimethyl-3-quinolin-8-ylbutan-1-amine
CID 81222761
N-[pyridin-3-yl(quinolin-8-yl)methyl]propan-1-amine
CID 81209832
N-[(4-bromothiophen-2-yl)-quinolin-8-ylmethyl]propan-1-amine
CID 81228406
N-[(5-methyloxolan-3-yl)-quinolin-8-ylmethyl]ethanamine
CID 105021388
N-[furan-3-yl(quinolin-8-yl)methyl]propan-1-amine
CID 81231183

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2,2-dimethyl-1-quinolin-8-ylbutan-1-amine?
The IUPAC name of N-ethyl-2,2-dimethyl-1-quinolin-8-ylbutan-1-amine (CID 105021242) is N-ethyl-2,2-dimethyl-1-quinolin-8-ylbutan-1-amine.
What is the SMILES notation for N-ethyl-2,2-dimethyl-1-quinolin-8-ylbutan-1-amine?
The canonical SMILES for N-ethyl-2,2-dimethyl-1-quinolin-8-ylbutan-1-amine is CCNC(c1cccc2cccnc12)C(C)(C)CC.
What is the InChIKey of N-ethyl-2,2-dimethyl-1-quinolin-8-ylbutan-1-amine?
The InChIKey is LRPDSQXEZKMCFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-5-17(3,4)16(18-6-2)14-11-7-9-13-10-8-12-19-15(13)14/h7-12,16,18H,5-6H2,1-4H3.
What are the key properties of N-ethyl-2,2-dimethyl-1-quinolin-8-ylbutan-1-amine?
N-ethyl-2,2-dimethyl-1-quinolin-8-ylbutan-1-amine has a molecular weight of 256.39 g/mol, XLogP of 4.32, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2,2-dimethyl-1-quinolin-8-ylbutan-1-amine is sourced from PubChem (CID 105021242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).