2-cyclopropyl-2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine

C16H24N2O — CID 116722251

IUPAC2-cyclopropyl-2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine
SMILESCNC(C1CCCc2cccnc21)C(OC)C1CC1
InChIInChI=1S/C16H24N2O/c1-17-15(16(19-2)12-8-9-12)13-7-3-5-11-6-4-10-18-14(11)13/h4,6,10,12-13,15-17H,3,5,7-9H2,1-2H3
InChIKeyJGMGCVKXZBESJE-UHFFFAOYSA-N
MW260.38 g/mol
LogP2.51
Rot. Bonds5

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

2-cyclopropyl-2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine (PubChem CID 116722251) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 2-cyclopropyl-2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine.

Molecular Properties

Compound Name2-cyclopropyl-2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine
PubChem CID116722251
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name2-cyclopropyl-2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine
SMILESCNC(C1CCCc2cccnc21)C(OC)C1CC1
InChIInChI=1S/C16H24N2O/c1-17-15(16(19-2)12-8-9-12)13-7-3-5-11-6-4-10-18-14(11)13/h4,6,10,12-13,15-17H,3,5,7-9H2,1-2H3
InChIKeyJGMGCVKXZBESJE-UHFFFAOYSA-N
XLogP2.51
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine
CID 116718864
[2-cyclohexyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-methoxyethyl]hydrazine
CID 105278691
N-methyl-1-(4-methylcyclohexyl)-1-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine
CID 79748851
N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79748588
(8R)-8-propan-2-yl-5,6,7,8-tetrahydroquinoline
CID 58752937
1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanol
CID 79739208
2-methoxy-3,3-dimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butan-1-ol
CID 116713188
N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)but-3-en-1-amine
CID 116660575
N-methyl-1-(2-methyl-3-pyridinyl)-1-(5,6,7,8-tetrahydroquinolin-8-yl)methanamine
CID 105164680
N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)pentan-1-amine
CID 79748892
N-(2,2-dimethoxyethyl)-5,6,7,8-tetrahydroquinolin-8-amine
CID 79080071
N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)-1-(thiolan-2-yl)methanamine
CID 80621797

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine?
The IUPAC name of 2-cyclopropyl-2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine (CID 116722251) is 2-cyclopropyl-2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine.
What is the SMILES notation for 2-cyclopropyl-2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine?
The canonical SMILES for 2-cyclopropyl-2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine is CNC(C1CCCc2cccnc21)C(OC)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine?
The InChIKey is JGMGCVKXZBESJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-17-15(16(19-2)12-8-9-12)13-7-3-5-11-6-4-10-18-14(11)13/h4,6,10,12-13,15-17H,3,5,7-9H2,1-2H3.
What are the key properties of 2-cyclopropyl-2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine?
2-cyclopropyl-2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine has a molecular weight of 260.38 g/mol, XLogP of 2.51, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-methoxy-N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanamine is sourced from PubChem (CID 116722251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).