N-propyl-4-quinolin-3-yloxypentan-1-amine

C17H24N2O — CID 107387881

IUPACN-propyl-4-quinolin-3-yloxypentan-1-amine
SMILESCCCNCCCC(C)Oc1cnc2ccccc2c1
InChIInChI=1S/C17H24N2O/c1-3-10-18-11-6-7-14(2)20-16-12-15-8-4-5-9-17(15)19-13-16/h4-5,8-9,12-14,18H,3,6-7,10-11H2,1-2H3
InChIKeyCUMYDKKOEZCZSY-UHFFFAOYSA-N
MW272.39 g/mol
LogP3.78
Rot. Bonds8

About N-propyl-4-quinolin-3-yloxypentan-1-amine

N-propyl-4-quinolin-3-yloxypentan-1-amine (PubChem CID 107387881) has the molecular formula C17H24N2O and a molecular weight of 272.39 g/mol. Its IUPAC name is N-propyl-4-quinolin-3-yloxypentan-1-amine.

Molecular Properties

Compound NameN-propyl-4-quinolin-3-yloxypentan-1-amine
PubChem CID107387881
Molecular FormulaC17H24N2O
Molecular Weight272.39 g/mol
Exact Mass272.19
IUPAC NameN-propyl-4-quinolin-3-yloxypentan-1-amine
SMILESCCCNCCCC(C)Oc1cnc2ccccc2c1
InChIInChI=1S/C17H24N2O/c1-3-10-18-11-6-7-14(2)20-16-12-15-8-4-5-9-17(15)19-13-16/h4-5,8-9,12-14,18H,3,6-7,10-11H2,1-2H3
InChIKeyCUMYDKKOEZCZSY-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-methyl-4-quinolin-3-yloxypentan-1-amine
CID 107387882
N-propyl-6-quinolin-3-yloxyhexan-1-amine
CID 107387874
N-propan-2-yl-2-quinolin-3-yloxypropan-1-amine
CID 107387828
(3R)-3-quinolin-3-yloxybutanoic acid
CID 107386787
N-(2-methylpropyl)-2-quinolin-3-yloxybutan-1-amine
CID 107387767
methyl 2-quinolin-3-yloxyhexanoate
CID 107386801
4-(3-tert-butylphenoxy)-N-propylpentan-1-amine
CID 63496113
N-tert-butyl-2-quinolin-3-yloxypentan-1-amine
CID 107387870
2-naphthalen-2-yloxy-N-propylpropan-1-amine
CID 42630142
2-methoxy-N-(2-quinolin-3-yloxyethyl)ethanamine
CID 97034151
2-quinolin-3-yloxybutan-1-amine
CID 107386996
4-(4-methylsulfanylphenoxy)-N-propylpentan-1-amine
CID 63647563

Frequently Asked Questions

What is the IUPAC name of N-propyl-4-quinolin-3-yloxypentan-1-amine?
The IUPAC name of N-propyl-4-quinolin-3-yloxypentan-1-amine (CID 107387881) is N-propyl-4-quinolin-3-yloxypentan-1-amine.
What is the SMILES notation for N-propyl-4-quinolin-3-yloxypentan-1-amine?
The canonical SMILES for N-propyl-4-quinolin-3-yloxypentan-1-amine is CCCNCCCC(C)Oc1cnc2ccccc2c1.
What is the InChIKey of N-propyl-4-quinolin-3-yloxypentan-1-amine?
The InChIKey is CUMYDKKOEZCZSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O/c1-3-10-18-11-6-7-14(2)20-16-12-15-8-4-5-9-17(15)19-13-16/h4-5,8-9,12-14,18H,3,6-7,10-11H2,1-2H3.
What are the key properties of N-propyl-4-quinolin-3-yloxypentan-1-amine?
N-propyl-4-quinolin-3-yloxypentan-1-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-propyl-4-quinolin-3-yloxypentan-1-amine is sourced from PubChem (CID 107387881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).