N-(3-ethoxypropyl)-2-quinolin-7-yloxypropan-1-amine

C17H24N2O2 — CID 107315345

IUPACN-(3-ethoxypropyl)-2-quinolin-7-yloxypropan-1-amine
SMILESCCOCCCNCC(C)Oc1ccc2cccnc2c1
InChIInChI=1S/C17H24N2O2/c1-3-20-11-5-9-18-13-14(2)21-16-8-7-15-6-4-10-19-17(15)12-16/h4,6-8,10,12,14,18H,3,5,9,11,13H2,1-2H3
InChIKeyJTGDLOXGMVRWCS-UHFFFAOYSA-N
MW288.39 g/mol
LogP3.02
Rot. Bonds9

About N-(3-ethoxypropyl)-2-quinolin-7-yloxypropan-1-amine

N-(3-ethoxypropyl)-2-quinolin-7-yloxypropan-1-amine (PubChem CID 107315345) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is N-(3-ethoxypropyl)-2-quinolin-7-yloxypropan-1-amine.

Molecular Properties

Compound NameN-(3-ethoxypropyl)-2-quinolin-7-yloxypropan-1-amine
PubChem CID107315345
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC NameN-(3-ethoxypropyl)-2-quinolin-7-yloxypropan-1-amine
SMILESCCOCCCNCC(C)Oc1ccc2cccnc2c1
InChIInChI=1S/C17H24N2O2/c1-3-20-11-5-9-18-13-14(2)21-16-8-7-15-6-4-10-19-17(15)12-16/h4,6-8,10,12,14,18H,3,5,9,11,13H2,1-2H3
InChIKeyJTGDLOXGMVRWCS-UHFFFAOYSA-N
XLogP3.02
TPSA43.38 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2-methylpropyl)-4-quinolin-7-yloxypentan-1-amine
CID 107315179
N-methyl-2-quinolin-7-yloxypropan-1-amine
CID 107313762
N-(3-ethoxypropyl)-2-(4-methoxyphenoxy)propan-1-amine
CID 62571705
2-(3,4-dimethylphenoxy)-N-(3-ethoxypropyl)propan-1-amine
CID 62572748
N-ethyl-2-quinolin-7-yloxyethanamine
CID 107313475
7-[(2R)-1-methoxypropan-2-yl]oxyquinoline
CID 141434593
2-methyl-N-(2-quinolin-7-yloxypropyl)propan-2-amine
CID 107314978
2-(3-tert-butylphenoxy)-N-(3-ethoxypropyl)propan-1-amine
CID 62597760
N-(3-ethoxypropyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propan-1-amine
CID 62583134
2-(4-chloro-3-ethylphenoxy)-N-(3-ethoxypropyl)propan-1-amine
CID 62597357
2-(2-ethoxyphenoxy)-N-(3-ethoxypropyl)propan-1-amine
CID 62572264
N-ethyl-6-quinolin-7-yloxyhexan-3-amine
CID 107313514

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxypropyl)-2-quinolin-7-yloxypropan-1-amine?
The IUPAC name of N-(3-ethoxypropyl)-2-quinolin-7-yloxypropan-1-amine (CID 107315345) is N-(3-ethoxypropyl)-2-quinolin-7-yloxypropan-1-amine.
What is the SMILES notation for N-(3-ethoxypropyl)-2-quinolin-7-yloxypropan-1-amine?
The canonical SMILES for N-(3-ethoxypropyl)-2-quinolin-7-yloxypropan-1-amine is CCOCCCNCC(C)Oc1ccc2cccnc2c1.
What is the InChIKey of N-(3-ethoxypropyl)-2-quinolin-7-yloxypropan-1-amine?
The InChIKey is JTGDLOXGMVRWCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-3-20-11-5-9-18-13-14(2)21-16-8-7-15-6-4-10-19-17(15)12-16/h4,6-8,10,12,14,18H,3,5,9,11,13H2,1-2H3.
What are the key properties of N-(3-ethoxypropyl)-2-quinolin-7-yloxypropan-1-amine?
N-(3-ethoxypropyl)-2-quinolin-7-yloxypropan-1-amine has a molecular weight of 288.39 g/mol, XLogP of 3.02, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxypropyl)-2-quinolin-7-yloxypropan-1-amine is sourced from PubChem (CID 107315345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).