N-methyl-3-(oxolan-2-yl)-1-quinolin-3-ylpropan-1-amine

C17H22N2O — CID 115797860

IUPACN-methyl-3-(oxolan-2-yl)-1-quinolin-3-ylpropan-1-amine
SMILESCNC(CCC1CCCO1)c1cnc2ccccc2c1
InChIInChI=1S/C17H22N2O/c1-18-16(9-8-15-6-4-10-20-15)14-11-13-5-2-3-7-17(13)19-12-14/h2-3,5,7,11-12,15-16,18H,4,6,8-10H2,1H3
InChIKeyTWOKDVJYGYKWJE-UHFFFAOYSA-N
MW270.38 g/mol
LogP3.45
Rot. Bonds5

About N-methyl-3-(oxolan-2-yl)-1-quinolin-3-ylpropan-1-amine

N-methyl-3-(oxolan-2-yl)-1-quinolin-3-ylpropan-1-amine (PubChem CID 115797860) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is N-methyl-3-(oxolan-2-yl)-1-quinolin-3-ylpropan-1-amine.

Molecular Properties

Compound NameN-methyl-3-(oxolan-2-yl)-1-quinolin-3-ylpropan-1-amine
PubChem CID115797860
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC NameN-methyl-3-(oxolan-2-yl)-1-quinolin-3-ylpropan-1-amine
SMILESCNC(CCC1CCCO1)c1cnc2ccccc2c1
InChIInChI=1S/C17H22N2O/c1-18-16(9-8-15-6-4-10-20-15)14-11-13-5-2-3-7-17(13)19-12-14/h2-3,5,7,11-12,15-16,18H,4,6,8-10H2,1H3
InChIKeyTWOKDVJYGYKWJE-UHFFFAOYSA-N
XLogP3.45
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-4-(oxolan-2-yl)-1-quinolin-6-ylbutan-1-amine
CID 65164208
N-methyl-1-(4-methylquinolin-2-yl)-3-(oxolan-2-yl)propan-1-amine
CID 114755171
N-methyl-3-(oxolan-2-yl)-1-pyridin-4-ylpropan-1-amine
CID 65167446
1-(4-bromophenyl)-N-methyl-3-(oxolan-2-yl)propan-1-amine
CID 65154712
1-isoquinolin-4-yl-N-methyl-3-(oxan-2-yl)propan-1-amine
CID 115856332
1-isoquinolin-5-yl-N-methyl-3-(oxolan-2-yl)propan-1-amine
CID 115853007
1-(3-bromo-4-methylphenyl)-N-methyl-3-(oxolan-2-yl)propan-1-amine
CID 104993732
4-ethoxy-N-methyl-1-quinolin-3-ylbutan-1-amine
CID 105097537
N-methyl-4-(oxolan-2-yl)-1-quinoxalin-6-ylbutan-1-amine
CID 65164718
N-methyl-1-naphthalen-2-yl-2-(oxolan-2-yl)ethanamine
CID 55104166
3-cyclopentyl-N-methyl-1-quinolin-6-ylpropan-1-amine
CID 105021015
N-methyl-1-quinolin-3-yl-2-(thian-4-yl)ethanamine
CID 105097613

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(oxolan-2-yl)-1-quinolin-3-ylpropan-1-amine?
The IUPAC name of N-methyl-3-(oxolan-2-yl)-1-quinolin-3-ylpropan-1-amine (CID 115797860) is N-methyl-3-(oxolan-2-yl)-1-quinolin-3-ylpropan-1-amine.
What is the SMILES notation for N-methyl-3-(oxolan-2-yl)-1-quinolin-3-ylpropan-1-amine?
The canonical SMILES for N-methyl-3-(oxolan-2-yl)-1-quinolin-3-ylpropan-1-amine is CNC(CCC1CCCO1)c1cnc2ccccc2c1.
What is the InChIKey of N-methyl-3-(oxolan-2-yl)-1-quinolin-3-ylpropan-1-amine?
The InChIKey is TWOKDVJYGYKWJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-18-16(9-8-15-6-4-10-20-15)14-11-13-5-2-3-7-17(13)19-12-14/h2-3,5,7,11-12,15-16,18H,4,6,8-10H2,1H3.
What are the key properties of N-methyl-3-(oxolan-2-yl)-1-quinolin-3-ylpropan-1-amine?
N-methyl-3-(oxolan-2-yl)-1-quinolin-3-ylpropan-1-amine has a molecular weight of 270.38 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(oxolan-2-yl)-1-quinolin-3-ylpropan-1-amine is sourced from PubChem (CID 115797860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).