N-methyl-3-propoxy-1-quinolin-8-ylpropan-1-amine

C16H22N2O — CID 105172455

IUPACN-methyl-3-propoxy-1-quinolin-8-ylpropan-1-amine
SMILESCCCOCCC(NC)c1cccc2cccnc12
InChIInChI=1S/C16H22N2O/c1-3-11-19-12-9-15(17-2)14-8-4-6-13-7-5-10-18-16(13)14/h4-8,10,15,17H,3,9,11-12H2,1-2H3
InChIKeyGESSDOZAMMOWRH-UHFFFAOYSA-N
MW258.36 g/mol
LogP3.31
Rot. Bonds7

About N-methyl-3-propoxy-1-quinolin-8-ylpropan-1-amine

N-methyl-3-propoxy-1-quinolin-8-ylpropan-1-amine (PubChem CID 105172455) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is N-methyl-3-propoxy-1-quinolin-8-ylpropan-1-amine.

Molecular Properties

Compound NameN-methyl-3-propoxy-1-quinolin-8-ylpropan-1-amine
PubChem CID105172455
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC NameN-methyl-3-propoxy-1-quinolin-8-ylpropan-1-amine
SMILESCCCOCCC(NC)c1cccc2cccnc12
InChIInChI=1S/C16H22N2O/c1-3-11-19-12-9-15(17-2)14-8-4-6-13-7-5-10-18-16(13)14/h4-8,10,15,17H,3,9,11-12H2,1-2H3
InChIKeyGESSDOZAMMOWRH-UHFFFAOYSA-N
XLogP3.31
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 53.31
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-1-quinolin-8-ylpent-4-yn-1-amine
CID 105148985
N-methyl-1-quinolin-8-ylbut-3-yn-1-amine
CID 105077186
ethyl 3-(methylamino)-3-quinolin-8-ylpropanoate
CID 65236794
3,3,3-trifluoro-N-methyl-1-quinolin-8-ylpropan-1-amine
CID 81231735
N-methyl-2-propoxy-1-quinoxalin-5-ylethanamine
CID 105165419
N-(2-methoxy-1-quinolin-8-ylethyl)propan-1-amine
CID 81231808
3-[3-ethoxy-1-(methylamino)propyl]pyridin-2-amine
CID 106815072
N-methyl-3-(1-methylpyrazol-4-yl)-1-quinolin-8-ylpropan-1-amine
CID 103029868
3-ethoxy-N-methyl-1-naphthalen-1-ylpropan-1-amine
CID 112688299
1-quinolin-8-ylbutan-1-amine
CID 79016206
2-(propan-2-ylamino)-2-quinolin-8-ylethanol
CID 63968321
2-ethoxy-2-ethyl-N-methyl-1-quinolin-8-ylbutan-1-amine
CID 116759944

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-propoxy-1-quinolin-8-ylpropan-1-amine?
The IUPAC name of N-methyl-3-propoxy-1-quinolin-8-ylpropan-1-amine (CID 105172455) is N-methyl-3-propoxy-1-quinolin-8-ylpropan-1-amine.
What is the SMILES notation for N-methyl-3-propoxy-1-quinolin-8-ylpropan-1-amine?
The canonical SMILES for N-methyl-3-propoxy-1-quinolin-8-ylpropan-1-amine is CCCOCCC(NC)c1cccc2cccnc12.
What is the InChIKey of N-methyl-3-propoxy-1-quinolin-8-ylpropan-1-amine?
The InChIKey is GESSDOZAMMOWRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-3-11-19-12-9-15(17-2)14-8-4-6-13-7-5-10-18-16(13)14/h4-8,10,15,17H,3,9,11-12H2,1-2H3.
What are the key properties of N-methyl-3-propoxy-1-quinolin-8-ylpropan-1-amine?
N-methyl-3-propoxy-1-quinolin-8-ylpropan-1-amine has a molecular weight of 258.36 g/mol, XLogP of 3.31, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-propoxy-1-quinolin-8-ylpropan-1-amine is sourced from PubChem (CID 105172455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).