1-[2-(4-aminopiperidin-1-yl)ethyl]-7-methoxyquinolin-2-one

C17H23N3O2 — CID 59398289

IUPAC1-[2-(4-aminopiperidin-1-yl)ethyl]-7-methoxyquinolin-2-one
SMILESCOc1ccc2ccc(=O)n(CCN3CCC(N)CC3)c2c1
InChIInChI=1S/C17H23N3O2/c1-22-15-4-2-13-3-5-17(21)20(16(13)12-15)11-10-19-8-6-14(18)7-9-19/h2-5,12,14H,6-11,18H2,1H3
InChIKeyYFMUXOZWVQGQFI-UHFFFAOYSA-N
MW301.39 g/mol
LogP1.43
Rot. Bonds4

About 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-methoxyquinolin-2-one

1-[2-(4-aminopiperidin-1-yl)ethyl]-7-methoxyquinolin-2-one (PubChem CID 59398289) has the molecular formula C17H23N3O2 and a molecular weight of 301.39 g/mol. Its IUPAC name is 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-methoxyquinolin-2-one.

Molecular Properties

Compound Name1-[2-(4-aminopiperidin-1-yl)ethyl]-7-methoxyquinolin-2-one
PubChem CID59398289
Molecular FormulaC17H23N3O2
Molecular Weight301.39 g/mol
Exact Mass301.18
IUPAC Name1-[2-(4-aminopiperidin-1-yl)ethyl]-7-methoxyquinolin-2-one
SMILESCOc1ccc2ccc(=O)n(CCN3CCC(N)CC3)c2c1
InChIInChI=1S/C17H23N3O2/c1-22-15-4-2-13-3-5-17(21)20(16(13)12-15)11-10-19-8-6-14(18)7-9-19/h2-5,12,14H,6-11,18H2,1H3
InChIKeyYFMUXOZWVQGQFI-UHFFFAOYSA-N
XLogP1.43
TPSA60.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

tert-butyl-[1-[2-(7-methoxy-2-oxoquinolin-1-yl)ethyl]piperidin-4-yl]carbamic acid
CID 66774842
1-[2-(6-methoxyindol-1-yl)ethyl]piperidin-4-amine
CID 141163156
7-fluoro-N-[1-[2-(7-methoxy-2-oxoquinolin-1-yl)ethyl]piperidin-4-yl]-N-methyl-2,3-dihydro-[1,4]dioxino[2,3-b]pyridine-6-carboxamide
CID 25160349
1-[2-[4-(2,3-dihydro-[1,4]dioxino[2,3-c]pyridin-7-ylmethylamino)piperidin-1-yl]ethyl]-7-methoxyquinolin-2-one
CID 11983362
3-(7-methoxy-2-oxoquinolin-1-yl)propanoic acid
CID 68631645
1-[2-(4-aminopiperidin-1-yl)ethyl]-5-fluoroquinolin-2-one
CID 174545471
1-[2-(4-amino-3-hydroxypiperidin-1-yl)ethyl]-7-methoxyquinoxalin-2-one;hydrochloride
CID 172706824
[1-[2-(7-cyano-2-oxoquinolin-1-yl)ethyl]piperidin-4-yl] carbamate
CID 175061198
1-[2-(4-amino-3-fluoropiperidin-1-yl)ethyl]-2-oxoquinoline-7-carbonitrile
CID 68610480
1-[2-[(3S,4R)-4-amino-3-hydroxypiperidin-1-yl]ethyl]-7-methoxy-1,5-naphthyridin-2-one;dihydrochloride
CID 67498576
1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-5-oxido-1,5-naphthyridin-5-ium-2-one
CID 68820161
1-[2-(4-aminopiperidin-1-yl)ethyl]-7-fluoro-1,5-naphthyridin-2-one;hydrochloride
CID 68927113

Frequently Asked Questions

What is the IUPAC name of 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-methoxyquinolin-2-one?
The IUPAC name of 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-methoxyquinolin-2-one (CID 59398289) is 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-methoxyquinolin-2-one.
What is the SMILES notation for 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-methoxyquinolin-2-one?
The canonical SMILES for 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-methoxyquinolin-2-one is COc1ccc2ccc(=O)n(CCN3CCC(N)CC3)c2c1.
What is the InChIKey of 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-methoxyquinolin-2-one?
The InChIKey is YFMUXOZWVQGQFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O2/c1-22-15-4-2-13-3-5-17(21)20(16(13)12-15)11-10-19-8-6-14(18)7-9-19/h2-5,12,14H,6-11,18H2,1H3.
What are the key properties of 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-methoxyquinolin-2-one?
1-[2-(4-aminopiperidin-1-yl)ethyl]-7-methoxyquinolin-2-one has a molecular weight of 301.39 g/mol, XLogP of 1.43, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(4-aminopiperidin-1-yl)ethyl]-7-methoxyquinolin-2-one is sourced from PubChem (CID 59398289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).