3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine

C16H26N2O — CID 79748513

IUPAC3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
SMILESCCCNC(CCOC)C1CCCc2cccnc21
InChIInChI=1S/C16H26N2O/c1-3-10-17-15(9-12-19-2)14-8-4-6-13-7-5-11-18-16(13)14/h5,7,11,14-15,17H,3-4,6,8-10,12H2,1-2H3
InChIKeySRGMUCHNDRJKON-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.91
Rot. Bonds7

About 3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine

3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine (PubChem CID 79748513) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine.

Molecular Properties

Compound Name3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
PubChem CID79748513
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
SMILESCCCNC(CCOC)C1CCCc2cccnc21
InChIInChI=1S/C16H26N2O/c1-3-10-17-15(9-12-19-2)14-8-4-6-13-7-5-11-18-16(13)14/h5,7,11,14-15,17H,3-4,6,8-10,12H2,1-2H3
InChIKeySRGMUCHNDRJKON-UHFFFAOYSA-N
XLogP2.91
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-(2-methoxyethoxy)-N-propylpropan-1-amine
CID 102928601
N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79748838
2-ethoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79747758
3-methoxy-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol
CID 79746208
N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79748588
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N',N'-diethyl-N-propylpropane-1,3-diamine
CID 79739951
N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine
CID 79748892
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-ethoxy-N-ethylpropan-1-amine
CID 105166170
2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine
CID 116718864
1-(5,6,7,8-tetrahydroquinolin-8-yl)hexylhydrazine
CID 105320905
8-pentan-2-yl-5,6,7,8-tetrahydroquinoline
CID 67125718
N-[1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-pyridin-4-ylethyl]propan-1-amine
CID 79732011

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine?
The IUPAC name of 3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine (CID 79748513) is 3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine.
What is the SMILES notation for 3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine?
The canonical SMILES for 3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine is CCCNC(CCOC)C1CCCc2cccnc21.
What is the InChIKey of 3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine?
The InChIKey is SRGMUCHNDRJKON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-3-10-17-15(9-12-19-2)14-8-4-6-13-7-5-11-18-16(13)14/h5,7,11,14-15,17H,3-4,6,8-10,12H2,1-2H3.
What are the key properties of 3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine?
3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine has a molecular weight of 262.40 g/mol, XLogP of 2.91, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine is sourced from PubChem (CID 79748513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).