(4-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone

C18H26N2O — CID 62850423

IUPAC(4-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone
SMILESCCCC1CCN(C(=O)c2cccc3c2CCCN3)CC1
InChIInChI=1S/C18H26N2O/c1-2-5-14-9-12-20(13-10-14)18(21)16-6-3-8-17-15(16)7-4-11-19-17/h3,6,8,14,19H,2,4-5,7,9-13H2,1H3
InChIKeyGCOOJQJTDNGFMD-UHFFFAOYSA-N
MW286.42 g/mol
LogP3.70
Rot. Bonds3

About (4-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone

(4-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone (PubChem CID 62850423) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is (4-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone.

Molecular Properties

Compound Name(4-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone
PubChem CID62850423
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC Name(4-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone
SMILESCCCC1CCN(C(=O)c2cccc3c2CCCN3)CC1
InChIInChI=1S/C18H26N2O/c1-2-5-14-9-12-20(13-10-14)18(21)16-6-3-8-17-15(16)7-4-11-19-17/h3,6,8,14,19H,2,4-5,7,9-13H2,1H3
InChIKeyGCOOJQJTDNGFMD-UHFFFAOYSA-N
XLogP3.70
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-(methoxymethyl)piperidin-1-yl]-(1,2,3,4-tetrahydroquinolin-5-yl)methanone
CID 63978245
(4-propylpiperazin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone
CID 62849338
(3-methylpyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone
CID 55126550
(4-ethylpiperazin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone
CID 62849515
[(3R)-3-hydroxypyrrolidin-1-yl]-(1,2,3,4-tetrahydroquinolin-5-yl)methanone
CID 107217199
(1,1-dioxo-1,4-thiazepan-4-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone
CID 104954785
(2,6-dimethylmorpholin-4-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone
CID 62850768
(2-methyl-1,4-oxazepan-4-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone
CID 62973493
[2-(hydroxymethyl)pyrrolidin-1-yl]-(1,2,3,4-tetrahydroquinolin-5-yl)methanone
CID 62849882
(3-hydroxy-3-methylpyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone
CID 103355979
1,3-dihydroisoindol-2-yl(1,2,3,4-tetrahydroquinolin-5-yl)methanone
CID 62850424
(2-bromo-3-pyridinyl)-(4-propylazepan-1-yl)methanone
CID 103752661

Frequently Asked Questions

What is the IUPAC name of (4-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone?
The IUPAC name of (4-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone (CID 62850423) is (4-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone.
What is the SMILES notation for (4-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone?
The canonical SMILES for (4-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone is CCCC1CCN(C(=O)c2cccc3c2CCCN3)CC1.
What is the InChIKey of (4-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone?
The InChIKey is GCOOJQJTDNGFMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-2-5-14-9-12-20(13-10-14)18(21)16-6-3-8-17-15(16)7-4-11-19-17/h3,6,8,14,19H,2,4-5,7,9-13H2,1H3.
What are the key properties of (4-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone?
(4-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone has a molecular weight of 286.42 g/mol, XLogP of 3.70, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-propylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinolin-5-yl)methanone is sourced from PubChem (CID 62850423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).