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

C15H24N2 — CID 79738591

IUPACN-propyl-3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
SMILESCCCNCCCC1CCCc2cccnc21
InChIInChI=1S/C15H24N2/c1-2-10-16-11-4-8-13-6-3-7-14-9-5-12-17-15(13)14/h5,9,12-13,16H,2-4,6-8,10-11H2,1H3
InChIKeyJPCGGBVXWKVAEN-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.28
Rot. Bonds6

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

N-propyl-3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine (PubChem CID 79738591) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is N-propyl-3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine.

Molecular Properties

Compound NameN-propyl-3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
PubChem CID79738591
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC NameN-propyl-3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
SMILESCCCNCCCC1CCCc2cccnc21
InChIInChI=1S/C15H24N2/c1-2-10-16-11-4-8-13-6-3-7-14-9-5-12-17-15(13)14/h5,9,12-13,16H,2-4,6-8,10-11H2,1H3
InChIKeyJPCGGBVXWKVAEN-UHFFFAOYSA-N
XLogP3.28
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 19851779
2-[(8S)-5,6,7,8-tetrahydroquinolin-8-yl]acetaldehyde
CID 93476901
5,6,7,8-tetrahydroquinolin-8-ylmethylhydrazine
CID 105220811
8-(3-chloro-4,4-dimethylpentyl)-5,6,7,8-tetrahydroquinoline
CID 79738883
N-propyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79748838
4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N-propylbut-3-en-1-amine
CID 79739069
N-propyl-3-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-amine
CID 79737789
8-[(E)-but-2-enyl]-5,6,7,8-tetrahydroquinoline
CID 67125733
N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79748588
N-propyl-4-(5,6,7,8-tetrahydroquinolin-8-yl)-1,2,5-thiadiazol-3-amine
CID 79739368
(8S)-5,6,7,8-tetrahydroquinolin-8-amine
CID 12031071
2-propyl-4-(5,6,7,8-tetrahydroquinolin-8-yl)oxan-4-ol
CID 79746070

Frequently Asked Questions

What is the IUPAC name of N-propyl-3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine?
The IUPAC name of N-propyl-3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine (CID 79738591) is N-propyl-3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine.
What is the SMILES notation for N-propyl-3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine?
The canonical SMILES for N-propyl-3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine is CCCNCCCC1CCCc2cccnc21.
What is the InChIKey of N-propyl-3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine?
The InChIKey is JPCGGBVXWKVAEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-2-10-16-11-4-8-13-6-3-7-14-9-5-12-17-15(13)14/h5,9,12-13,16H,2-4,6-8,10-11H2,1H3.
What are the key properties of N-propyl-3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine?
N-propyl-3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine has a molecular weight of 232.37 g/mol, XLogP of 3.28, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-3-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine is sourced from PubChem (CID 79738591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).