7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one

C17H24N2O2 — CID 141163160

IUPAC7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one
SMILESCOc1ccc2c(c1)N(CCN1CCCCC1)C(=O)CC2
InChIInChI=1S/C17H24N2O2/c1-21-15-7-5-14-6-8-17(20)19(16(14)13-15)12-11-18-9-3-2-4-10-18/h5,7,13H,2-4,6,8-12H2,1H3
InChIKeyRGAJFDUNQRGCFM-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.46
Rot. Bonds4

About 7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one

7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one (PubChem CID 141163160) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one
PubChem CID141163160
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one
SMILESCOc1ccc2c(c1)N(CCN1CCCCC1)C(=O)CC2
InChIInChI=1S/C17H24N2O2/c1-21-15-7-5-14-6-8-17(20)19(16(14)13-15)12-11-18-9-3-2-4-10-18/h5,7,13H,2-4,6,8-12H2,1H3
InChIKeyRGAJFDUNQRGCFM-UHFFFAOYSA-N
XLogP2.46
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(hydroxymethyl)-7-methoxy-3,4-dihydroquinolin-2-one
CID 135138136
2-(7-methoxy-2-oxo-3,4-dihydroquinolin-1-yl)acetaldehyde
CID 153165592
1-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-7-methoxy-3,4-dihydroquinolin-2-one
CID 10645430
1-benzyl-7-(3-piperidin-1-ylpropoxy)-3,4-dihydroquinolin-2-one
CID 90654937
1-[2-(8-methoxy-2,3,4,5-tetrahydro-1-benzazepin-1-yl)ethyl]pyrrolidin-2-one
CID 71855025
2-(8-methoxy-2-oxo-4,5-dihydro-3H-1-benzazepin-1-yl)acetonitrile
CID 142193898
4-[[2-oxo-7-(2-piperidin-1-ylethoxy)-3,4-dihydroquinolin-1-yl]methyl]benzoic acid
CID 175305736
1-(2-piperidin-1-ylethyl)pyrrolidine-2,5-dione
CID 141389881
2-oxo-1-(2-pyrrolidin-1-ylethyl)-3,4-dihydroquinoline-6-carboxylic acid
CID 102711309
1-(4-bromobutyl)-6-methoxy-3,4-dihydroquinolin-2-one
CID 67152877
ethane;3-(6-methoxy-2-oxo-3,4-dihydroquinolin-1-yl)propanoic acid
CID 143541163
1-ethyl-8-methoxy-2,3,4,5-tetrahydro-1-benzazepine
CID 86703343

Frequently Asked Questions

What is the IUPAC name of 7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one?
The IUPAC name of 7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one (CID 141163160) is 7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one?
The canonical SMILES for 7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one is COc1ccc2c(c1)N(CCN1CCCCC1)C(=O)CC2.
What is the InChIKey of 7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one?
The InChIKey is RGAJFDUNQRGCFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-21-15-7-5-14-6-8-17(20)19(16(14)13-15)12-11-18-9-3-2-4-10-18/h5,7,13H,2-4,6,8-12H2,1H3.
What are the key properties of 7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one?
7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one has a molecular weight of 288.39 g/mol, XLogP of 2.46, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methoxy-1-(2-piperidin-1-ylethyl)-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 141163160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).