N-[[3-(2-oxoazetidin-1-yl)phenyl]methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide

C21H21N3O3 — CID 166410295

IUPACN-[[3-(2-oxoazetidin-1-yl)phenyl]methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide
SMILESO=C(Cc1ccc2c(c1)CCC(=O)N2)NCc1cccc(N2CCC2=O)c1
InChIInChI=1S/C21H21N3O3/c25-19-7-5-16-10-14(4-6-18(16)23-19)12-20(26)22-13-15-2-1-3-17(11-15)24-9-8-21(24)27/h1-4,6,10-11H,5,7-9,12-13H2,(H,22,26)(H,23,25)
InChIKeyIINKLQSLARENAS-UHFFFAOYSA-N
MW363.42 g/mol
LogP2.17
Rot. Bonds5

About N-[[3-(2-oxoazetidin-1-yl)phenyl]methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide

N-[[3-(2-oxoazetidin-1-yl)phenyl]methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide (PubChem CID 166410295) has the molecular formula C21H21N3O3 and a molecular weight of 363.42 g/mol. Its IUPAC name is N-[[3-(2-oxoazetidin-1-yl)phenyl]methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide.

Molecular Properties

Compound NameN-[[3-(2-oxoazetidin-1-yl)phenyl]methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide
PubChem CID166410295
Molecular FormulaC21H21N3O3
Molecular Weight363.42 g/mol
Exact Mass363.16
IUPAC NameN-[[3-(2-oxoazetidin-1-yl)phenyl]methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide
SMILESO=C(Cc1ccc2c(c1)CCC(=O)N2)NCc1cccc(N2CCC2=O)c1
InChIInChI=1S/C21H21N3O3/c25-19-7-5-16-10-14(4-6-18(16)23-19)12-20(26)22-13-15-2-1-3-17(11-15)24-9-8-21(24)27/h1-4,6,10-11H,5,7-9,12-13H2,(H,22,26)(H,23,25)
InChIKeyIINKLQSLARENAS-UHFFFAOYSA-N
XLogP2.17
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.42
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[[3-(2-oxoazetidin-1-yl)phenyl]methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide with MolForge

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Related Compounds

N-[(4-fluorophenyl)methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide
CID 110768429
2-amino-N-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)methyl]acetamide
CID 82496063
1-benzyl-3-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)methyl]urea
CID 110775001
N-[(2-methylphenyl)methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide
CID 110768423
2-(3-methoxyphenyl)-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide
CID 110788667
N-[(3-chlorophenyl)methyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 86911732
3-methyl-N-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)methyl]benzamide
CID 110781541
4-fluoro-N-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)methyl]benzamide
CID 110781545
N'-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)methyl]oxamide
CID 115191821
1-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)methyl]-3-phenylurea
CID 110774998
N-[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)methyl]-2-pyridin-2-ylsulfanylacetamide
CID 26434790
N-[2-(1H-indol-3-yl)ethyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide
CID 110768453

Frequently Asked Questions

What is the IUPAC name of N-[[3-(2-oxoazetidin-1-yl)phenyl]methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide?
The IUPAC name of N-[[3-(2-oxoazetidin-1-yl)phenyl]methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide (CID 166410295) is N-[[3-(2-oxoazetidin-1-yl)phenyl]methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide.
What is the SMILES notation for N-[[3-(2-oxoazetidin-1-yl)phenyl]methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide?
The canonical SMILES for N-[[3-(2-oxoazetidin-1-yl)phenyl]methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide is O=C(Cc1ccc2c(c1)CCC(=O)N2)NCc1cccc(N2CCC2=O)c1.
What is the InChIKey of N-[[3-(2-oxoazetidin-1-yl)phenyl]methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide?
The InChIKey is IINKLQSLARENAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O3/c25-19-7-5-16-10-14(4-6-18(16)23-19)12-20(26)22-13-15-2-1-3-17(11-15)24-9-8-21(24)27/h1-4,6,10-11H,5,7-9,12-13H2,(H,22,26)(H,23,25).
What are the key properties of N-[[3-(2-oxoazetidin-1-yl)phenyl]methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide?
N-[[3-(2-oxoazetidin-1-yl)phenyl]methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide has a molecular weight of 363.42 g/mol, XLogP of 2.17, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(2-oxoazetidin-1-yl)phenyl]methyl]-2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)acetamide is sourced from PubChem (CID 166410295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).