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

C12H18N2 — CID 19851779

IUPAC3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
SMILESNCCCC1CCCc2cccnc21
InChIInChI=1S/C12H18N2/c13-8-2-6-10-4-1-5-11-7-3-9-14-12(10)11/h3,7,9-10H,1-2,4-6,8,13H2
InChIKeyINYNBVMGVKETPL-UHFFFAOYSA-N
MW190.29 g/mol
LogP2.24
Rot. Bonds3

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

3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine (PubChem CID 19851779) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine.

Molecular Properties

Compound Name3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
PubChem CID19851779
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
SMILESNCCCC1CCCc2cccnc21
InChIInChI=1S/C12H18N2/c13-8-2-6-10-4-1-5-11-7-3-9-14-12(10)11/h3,7,9-10H,1-2,4-6,8,13H2
InChIKeyINYNBVMGVKETPL-UHFFFAOYSA-N
XLogP2.24
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-propyl-3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79738591
5,6,7,8-tetrahydroquinolin-8-ylmethylhydrazine
CID 105220811
(8S)-5,6,7,8-tetrahydroquinolin-8-amine
CID 12031071
2-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]acetaldehyde
CID 93476901
N'-(5,6,7,8-tetrahydroquinolin-8-yl)hexane-1,6-diamine
CID 142667915
8-(3-chloro-4,4-dimethylpentyl)-5,6,7,8-tetrahydroquinoline
CID 79738883
8-[(E)-but-2-enyl]-5,6,7,8-tetrahydroquinoline
CID 67125733
2-(6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-9-yl)acetamide
CID 141070718
(8S)-8-fluoro-5,6,7,8-tetrahydroquinoline
CID 164583093
(8R)-8-fluoro-5,6,7,8-tetrahydroquinoline
CID 162400504
2-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 81021345
N'-[(3-chloro-2-pyridinyl)methyl]-N'-(5,6,7,8-tetrahydroquinolin-8-yl)butane-1,4-diamine
CID 25177627

Frequently Asked Questions

What is the IUPAC name of 3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine?
The IUPAC name of 3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine (CID 19851779) is 3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine.
What is the SMILES notation for 3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine?
The canonical SMILES for 3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine is NCCCC1CCCc2cccnc21.
What is the InChIKey of 3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine?
The InChIKey is INYNBVMGVKETPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c13-8-2-6-10-4-1-5-11-7-3-9-14-12(10)11/h3,7,9-10H,1-2,4-6,8,13H2.
What are the key properties of 3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine?
3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine has a molecular weight of 190.29 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine is sourced from PubChem (CID 19851779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).