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

C16H26N2O — CID 79745841

IUPAC3-(diethylamino)-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol
SMILESCCN(CC)CCC(O)C1CCCc2cccnc21
InChIInChI=1S/C16H26N2O/c1-3-18(4-2)12-10-15(19)14-9-5-7-13-8-6-11-17-16(13)14/h6,8,11,14-15,19H,3-5,7,9-10,12H2,1-2H3
InChIKeyIXJMETIPIJRLNV-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.59
Rot. Bonds6

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

3-(diethylamino)-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol (PubChem CID 79745841) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is 3-(diethylamino)-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol.

Molecular Properties

Compound Name3-(diethylamino)-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol
PubChem CID79745841
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name3-(diethylamino)-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol
SMILESCCN(CC)CCC(O)C1CCCc2cccnc21
InChIInChI=1S/C16H26N2O/c1-3-18(4-2)12-10-15(19)14-9-5-7-13-8-6-11-17-16(13)14/h6,8,11,14-15,19H,3-5,7,9-10,12H2,1-2H3
InChIKeyIXJMETIPIJRLNV-UHFFFAOYSA-N
XLogP2.59
TPSA36.36 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 ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-methoxy-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol
CID 79746208
4-methylsulfanyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)butan-1-ol
CID 103089942
1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanol
CID 79739208
8-pentan-2-yl-5,6,7,8-tetrahydroquinoline
CID 67125718
2-phenoxy-1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanol
CID 79745977
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-N',N'-diethyl-N-propylpropane-1,3-diamine
CID 79739951
1-(5,6,7,8-tetrahydroquinolin-8-yl)butan-1-amine
CID 79748417
(8R)-8-propan-2-yl-5,6,7,8-tetrahydroquinoline
CID 58752937
N',N'-diethyl-N-[(8R)-5,6,7,8-tetrahydroquinolin-8-yl]ethane-1,2-diamine
CID 97132888
3,5,5-trimethyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)hexan-1-ol
CID 115818295
(3-ethylcyclopentyl)-(5,6,7,8-tetrahydroquinolin-8-yl)methanol
CID 79746219
N-methyl-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-amine
CID 79748588

Frequently Asked Questions

What is the IUPAC name of 3-(diethylamino)-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol?
The IUPAC name of 3-(diethylamino)-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol (CID 79745841) is 3-(diethylamino)-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol.
What is the SMILES notation for 3-(diethylamino)-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol?
The canonical SMILES for 3-(diethylamino)-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol is CCN(CC)CCC(O)C1CCCc2cccnc21.
What is the InChIKey of 3-(diethylamino)-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol?
The InChIKey is IXJMETIPIJRLNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-3-18(4-2)12-10-15(19)14-9-5-7-13-8-6-11-17-16(13)14/h6,8,11,14-15,19H,3-5,7,9-10,12H2,1-2H3.
What are the key properties of 3-(diethylamino)-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol?
3-(diethylamino)-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol has a molecular weight of 262.40 g/mol, XLogP of 2.59, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylamino)-1-(5,6,7,8-tetrahydroquinolin-8-yl)propan-1-ol is sourced from PubChem (CID 79745841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).