2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine

C16H26N2O — CID 116718864

IUPAC2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine
SMILESCCCC(OC)C(NC)C1CCCc2cccnc21
InChIInChI=1S/C16H26N2O/c1-4-7-14(19-3)16(17-2)13-10-5-8-12-9-6-11-18-15(12)13/h6,9,11,13-14,16-17H,4-5,7-8,10H2,1-3H3
InChIKeyATNGTVWRUYDFJV-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.90
Rot. Bonds6

About 2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine

2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine (PubChem CID 116718864) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine.

Molecular Properties

Compound Name2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine
PubChem CID116718864
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine
SMILESCCCC(OC)C(NC)C1CCCc2cccnc21
InChIInChI=1S/C16H26N2O/c1-4-7-14(19-3)16(17-2)13-10-5-8-12-9-6-11-18-15(12)13/h6,9,11,13-14,16-17H,4-5,7-8,10H2,1-3H3
InChIKeyATNGTVWRUYDFJV-UHFFFAOYSA-N
XLogP2.90
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-cyclopropyl-2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine
CID 116722251
8-pentan-2-yl-5,6,7,8-tetrahydroquinoline
CID 67125718
N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine
CID 79748892
N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79748588
1-(5,6,7,8-tetrahydroquinolin-8-yl)butan-1-amine
CID 79748417
2-ethoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79747758
3-methoxy-N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79748513
(8R)-8-propan-2-yl-5,6,7,8-tetrahydroquinoline
CID 58752937
N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)but-3-en-1-amine
CID 116660575
3-methoxy-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol
CID 79746208
N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79748838
N-methyl-1-(4-methylcyclohexyl)-1-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine
CID 79748851

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine?
The IUPAC name of 2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine (CID 116718864) is 2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine.
What is the SMILES notation for 2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine?
The canonical SMILES for 2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine is CCCC(OC)C(NC)C1CCCc2cccnc21.
What is the InChIKey of 2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine?
The InChIKey is ATNGTVWRUYDFJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-4-7-14(19-3)16(17-2)13-10-5-8-12-9-6-11-18-15(12)13/h6,9,11,13-14,16-17H,4-5,7-8,10H2,1-3H3.
What are the key properties of 2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine?
2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine has a molecular weight of 262.40 g/mol, XLogP of 2.90, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine is sourced from PubChem (CID 116718864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).