1-[1-(4-methoxybenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one

C22H24N2O3 — CID 14969535

IUPAC1-[1-(4-methoxybenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one
SMILESCOc1ccc(C(=O)N2CCC(N3C(=O)CCc4ccccc43)CC2)cc1
InChIInChI=1S/C22H24N2O3/c1-27-19-9-6-17(7-10-19)22(26)23-14-12-18(13-15-23)24-20-5-3-2-4-16(20)8-11-21(24)25/h2-7,9-10,18H,8,11-15H2,1H3
InChIKeyVYUJEBMBEWTQDD-UHFFFAOYSA-N
MW364.45 g/mol
LogP3.28
Rot. Bonds3

About 1-[1-(4-methoxybenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one

1-[1-(4-methoxybenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one (PubChem CID 14969535) has the molecular formula C22H24N2O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is 1-[1-(4-methoxybenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name1-[1-(4-methoxybenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one
PubChem CID14969535
Molecular FormulaC22H24N2O3
Molecular Weight364.45 g/mol
Exact Mass364.18
IUPAC Name1-[1-(4-methoxybenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one
SMILESCOc1ccc(C(=O)N2CCC(N3C(=O)CCc4ccccc43)CC2)cc1
InChIInChI=1S/C22H24N2O3/c1-27-19-9-6-17(7-10-19)22(26)23-14-12-18(13-15-23)24-20-5-3-2-4-16(20)8-11-21(24)25/h2-7,9-10,18H,8,11-15H2,1H3
InChIKeyVYUJEBMBEWTQDD-UHFFFAOYSA-N
XLogP3.28
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

Encainide
CID 48041
Encainide Hydrochloride
CID 48040
N-(3-(4-((4-(3,4-Dihydro-2-oxo-1(2H)-quinolinyl)-1-piperidinyl)carbonyl)phenoxy)propyl)acetamide
CID 114904
Vesnarinone
CID 5663
4-methoxy-N-[4-(4-methyl-1-piperazinyl)phenyl]benzamide
CID 3154679
3,4-dihydro-1(2H)-quinolinyl(4-methoxyphenyl)methanone
CID 710667
N-((2S,4R)-1-(3-methoxybenzoyl)-2-methyl-1,2,3,4-tetrahydroquinolin-4-yl)-N-phenylacetamide
CID 7097680
1-[4-[4-(2-Methoxyphenyl)piperazin-1-yl]butyl]-3,4-dihydroquinolin-2-one
CID 10340555
1-(4-Ethoxybenzoyl)indoline
CID 669395
4-Methoxyphenyl 4-(2-methoxyphenyl)piperazinyl ketone
CID 722098
4-Methoxy-N-[2-(morpholine-4-carbonyl)-phenyl]-benzamide
CID 727270
N-Methyl-P-anisanilide
CID 292687

Frequently Asked Questions

What is the IUPAC name of 1-[1-(4-methoxybenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one?
The IUPAC name of 1-[1-(4-methoxybenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one (CID 14969535) is 1-[1-(4-methoxybenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 1-[1-(4-methoxybenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one?
The canonical SMILES for 1-[1-(4-methoxybenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one is COc1ccc(C(=O)N2CCC(N3C(=O)CCc4ccccc43)CC2)cc1.
What is the InChIKey of 1-[1-(4-methoxybenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one?
The InChIKey is VYUJEBMBEWTQDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3/c1-27-19-9-6-17(7-10-19)22(26)23-14-12-18(13-15-23)24-20-5-3-2-4-16(20)8-11-21(24)25/h2-7,9-10,18H,8,11-15H2,1H3.
What are the key properties of 1-[1-(4-methoxybenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one?
1-[1-(4-methoxybenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one has a molecular weight of 364.45 g/mol, XLogP of 3.28, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(4-methoxybenzoyl)piperidin-4-yl]-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 14969535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).