3-ethoxy-N,4-dimethyl-1-quinolin-2-ylpentan-2-amine

C18H26N2O — CID 116721300

IUPAC3-ethoxy-N,4-dimethyl-1-quinolin-2-ylpentan-2-amine
SMILESCCOC(C(C)C)C(Cc1ccc2ccccc2n1)NC
InChIInChI=1S/C18H26N2O/c1-5-21-18(13(2)3)17(19-4)12-15-11-10-14-8-6-7-9-16(14)20-15/h6-11,13,17-19H,5,12H2,1-4H3
InChIKeyGNKONDGHVROHAU-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.43
Rot. Bonds7

About 3-ethoxy-N,4-dimethyl-1-quinolin-2-ylpentan-2-amine

3-ethoxy-N,4-dimethyl-1-quinolin-2-ylpentan-2-amine (PubChem CID 116721300) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is 3-ethoxy-N,4-dimethyl-1-quinolin-2-ylpentan-2-amine.

Molecular Properties

Compound Name3-ethoxy-N,4-dimethyl-1-quinolin-2-ylpentan-2-amine
PubChem CID116721300
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC Name3-ethoxy-N,4-dimethyl-1-quinolin-2-ylpentan-2-amine
SMILESCCOC(C(C)C)C(Cc1ccc2ccccc2n1)NC
InChIInChI=1S/C18H26N2O/c1-5-21-18(13(2)3)17(19-4)12-15-11-10-14-8-6-7-9-16(14)20-15/h6-11,13,17-19H,5,12H2,1-4H3
InChIKeyGNKONDGHVROHAU-UHFFFAOYSA-N
XLogP3.43
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethoxy-N,4-dimethyl-1-(1-methylbenzimidazol-2-yl)pentan-2-amine
CID 116721301
3-ethoxy-N,4-dimethyl-1-(2-methylphenyl)pentan-2-amine
CID 116721266
2-methyl-N-(quinolin-2-ylmethyl)pentan-3-amine
CID 54954967
ethyl 2-methyl-3-quinolin-2-ylpropanoate
CID 59134939
4-methyl-2-(methylamino)-1-quinolin-2-ylpentan-3-one
CID 71153530
ethyl 2-amino-3-quinolin-2-ylpropanoate
CID 5002488
1-(1-benzothiophen-3-yl)-3-ethoxy-N,4-dimethylpentan-2-amine
CID 116721185
2-ethoxy-N,3-dimethyl-1-quinolin-3-ylbutan-1-amine
CID 116721032
1-(3,4-dimethylphenyl)-3-ethoxy-N,4-dimethylpentan-2-amine
CID 116721264
1-(2-chloro-3-fluorophenyl)-3-ethoxy-N,4-dimethylpentan-2-amine
CID 116721172
3-ethoxy-1-(3-ethyl-1-methylpyrazol-5-yl)-N,4-dimethylpentan-2-amine
CID 116721025
3-methyl-4-quinolin-2-ylbutan-1-amine
CID 81014327

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N,4-dimethyl-1-quinolin-2-ylpentan-2-amine?
The IUPAC name of 3-ethoxy-N,4-dimethyl-1-quinolin-2-ylpentan-2-amine (CID 116721300) is 3-ethoxy-N,4-dimethyl-1-quinolin-2-ylpentan-2-amine.
What is the SMILES notation for 3-ethoxy-N,4-dimethyl-1-quinolin-2-ylpentan-2-amine?
The canonical SMILES for 3-ethoxy-N,4-dimethyl-1-quinolin-2-ylpentan-2-amine is CCOC(C(C)C)C(Cc1ccc2ccccc2n1)NC.
What is the InChIKey of 3-ethoxy-N,4-dimethyl-1-quinolin-2-ylpentan-2-amine?
The InChIKey is GNKONDGHVROHAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-5-21-18(13(2)3)17(19-4)12-15-11-10-14-8-6-7-9-16(14)20-15/h6-11,13,17-19H,5,12H2,1-4H3.
What are the key properties of 3-ethoxy-N,4-dimethyl-1-quinolin-2-ylpentan-2-amine?
3-ethoxy-N,4-dimethyl-1-quinolin-2-ylpentan-2-amine has a molecular weight of 286.42 g/mol, XLogP of 3.43, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N,4-dimethyl-1-quinolin-2-ylpentan-2-amine is sourced from PubChem (CID 116721300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).