N-ethyl-6-quinolin-7-yloxyhexan-3-amine

C17H24N2O — CID 107313514

IUPACN-ethyl-6-quinolin-7-yloxyhexan-3-amine
SMILESCCNC(CC)CCCOc1ccc2cccnc2c1
InChIInChI=1S/C17H24N2O/c1-3-15(18-4-2)8-6-12-20-16-10-9-14-7-5-11-19-17(14)13-16/h5,7,9-11,13,15,18H,3-4,6,8,12H2,1-2H3
InChIKeyRMNDAFRDPHFABE-UHFFFAOYSA-N
MW272.39 g/mol
LogP3.78
Rot. Bonds8

About N-ethyl-6-quinolin-7-yloxyhexan-3-amine

N-ethyl-6-quinolin-7-yloxyhexan-3-amine (PubChem CID 107313514) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is N-ethyl-6-quinolin-7-yloxyhexan-3-amine.

Molecular Properties

Compound NameN-ethyl-6-quinolin-7-yloxyhexan-3-amine
PubChem CID107313514
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC NameN-ethyl-6-quinolin-7-yloxyhexan-3-amine
SMILESCCNC(CC)CCCOc1ccc2cccnc2c1
InChIInChI=1S/C17H24N2O/c1-3-15(18-4-2)8-6-12-20-16-10-9-14-7-5-11-19-17(14)13-16/h5,7,9-11,13,15,18H,3-4,6,8,12H2,1-2H3
InChIKeyRMNDAFRDPHFABE-UHFFFAOYSA-N
XLogP3.78
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-ethyl-2-quinolin-7-yloxyethanamine
CID 107313475
N-propan-2-yl-5-quinolin-7-yloxypentan-1-amine
CID 107314998
2-(methylamino)-4-quinolin-7-yloxybutan-1-ol
CID 107315572
3-quinolin-7-yloxypropane-1-thiol
CID 107315768
6-quinolin-7-yloxyhexan-1-ol
CID 107705479
6-(3,5-dimethoxyphenoxy)-N-ethylhexan-3-amine
CID 106800899
6-(3,5-dimethylphenoxy)-N-ethylhexan-3-amine
CID 106800724
N-ethyl-1-quinolin-7-ylhexan-3-amine
CID 81221619
N-(3-ethoxypropyl)-2-quinolin-7-yloxypropan-1-amine
CID 107315345
N-(3-quinolin-7-yloxypropyl)aniline
CID 107315213
3-ethoxy-N-ethyl-1-quinolin-7-ylpropan-1-amine
CID 105172706
6-(4-tert-butylphenoxy)-N-ethylhexan-3-amine
CID 106800707

Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-quinolin-7-yloxyhexan-3-amine?
The IUPAC name of N-ethyl-6-quinolin-7-yloxyhexan-3-amine (CID 107313514) is N-ethyl-6-quinolin-7-yloxyhexan-3-amine.
What is the SMILES notation for N-ethyl-6-quinolin-7-yloxyhexan-3-amine?
The canonical SMILES for N-ethyl-6-quinolin-7-yloxyhexan-3-amine is CCNC(CC)CCCOc1ccc2cccnc2c1.
What is the InChIKey of N-ethyl-6-quinolin-7-yloxyhexan-3-amine?
The InChIKey is RMNDAFRDPHFABE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-3-15(18-4-2)8-6-12-20-16-10-9-14-7-5-11-19-17(14)13-16/h5,7,9-11,13,15,18H,3-4,6,8,12H2,1-2H3.
What are the key properties of N-ethyl-6-quinolin-7-yloxyhexan-3-amine?
N-ethyl-6-quinolin-7-yloxyhexan-3-amine has a molecular weight of 272.39 g/mol, XLogP of 3.78, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-quinolin-7-yloxyhexan-3-amine is sourced from PubChem (CID 107313514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).