3-ethyl-3-methoxy-N-methyl-1-quinolin-4-ylpentan-2-amine

C18H26N2O — CID 116760813

IUPAC3-ethyl-3-methoxy-N-methyl-1-quinolin-4-ylpentan-2-amine
SMILESCCC(CC)(OC)C(Cc1ccnc2ccccc12)NC
InChIInChI=1S/C18H26N2O/c1-5-18(6-2,21-4)17(19-3)13-14-11-12-20-16-10-8-7-9-15(14)16/h7-12,17,19H,5-6,13H2,1-4H3
InChIKeyACYUDSRMTLHBPU-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.57
Rot. Bonds7

About 3-ethyl-3-methoxy-N-methyl-1-quinolin-4-ylpentan-2-amine

3-ethyl-3-methoxy-N-methyl-1-quinolin-4-ylpentan-2-amine (PubChem CID 116760813) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is 3-ethyl-3-methoxy-N-methyl-1-quinolin-4-ylpentan-2-amine.

Molecular Properties

Compound Name3-ethyl-3-methoxy-N-methyl-1-quinolin-4-ylpentan-2-amine
PubChem CID116760813
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC Name3-ethyl-3-methoxy-N-methyl-1-quinolin-4-ylpentan-2-amine
SMILESCCC(CC)(OC)C(Cc1ccnc2ccccc12)NC
InChIInChI=1S/C18H26N2O/c1-5-18(6-2,21-4)17(19-3)13-14-11-12-20-16-10-8-7-9-15(14)16/h7-12,17,19H,5-6,13H2,1-4H3
InChIKeyACYUDSRMTLHBPU-UHFFFAOYSA-N
XLogP3.57
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 ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-3-methoxy-3-methyl-1-quinolin-4-ylpentan-2-amine
CID 116757907
3-ethyl-3-methoxy-N-methyl-1-phenylpentan-2-amine
CID 116760798
4-(2-ethylbutyl)quinoline
CID 143495355
4-ethoxy-N-methyl-1-quinolin-4-ylbutan-2-amine
CID 105159304
5,5,5-trifluoro-N-methyl-1-quinolin-4-ylpentan-2-amine
CID 79954929
N,4-dimethyl-1-quinolin-4-ylhexan-2-amine
CID 104997356
4-(2-chlorobutyl)quinoline
CID 63203241
3-methoxy-3-oxo-2-(quinolin-4-ylmethyl)propanoic acid
CID 103973243
1-cyclopropyl-1-ethoxy-N-methyl-3-quinolin-4-ylpropan-2-amine
CID 116723331
N-methoxy-1-quinolin-4-ylmethanamine
CID 79235633
1-(3-ethylthiophen-2-yl)-N-methyl-2-quinolin-4-ylethanamine
CID 104997344
3-ethyl-3-methoxy-N-methyl-1-(1-methylimidazol-2-yl)pentan-2-amine
CID 116760949

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-3-methoxy-N-methyl-1-quinolin-4-ylpentan-2-amine?
The IUPAC name of 3-ethyl-3-methoxy-N-methyl-1-quinolin-4-ylpentan-2-amine (CID 116760813) is 3-ethyl-3-methoxy-N-methyl-1-quinolin-4-ylpentan-2-amine.
What is the SMILES notation for 3-ethyl-3-methoxy-N-methyl-1-quinolin-4-ylpentan-2-amine?
The canonical SMILES for 3-ethyl-3-methoxy-N-methyl-1-quinolin-4-ylpentan-2-amine is CCC(CC)(OC)C(Cc1ccnc2ccccc12)NC.
What is the InChIKey of 3-ethyl-3-methoxy-N-methyl-1-quinolin-4-ylpentan-2-amine?
The InChIKey is ACYUDSRMTLHBPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-5-18(6-2,21-4)17(19-3)13-14-11-12-20-16-10-8-7-9-15(14)16/h7-12,17,19H,5-6,13H2,1-4H3.
What are the key properties of 3-ethyl-3-methoxy-N-methyl-1-quinolin-4-ylpentan-2-amine?
3-ethyl-3-methoxy-N-methyl-1-quinolin-4-ylpentan-2-amine has a molecular weight of 286.42 g/mol, XLogP of 3.57, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-3-methoxy-N-methyl-1-quinolin-4-ylpentan-2-amine is sourced from PubChem (CID 116760813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).