2-(7-chloro-4-oxoquinolin-1-yl)-N,N-diethylacetamide

C15H17ClN2O2 — CID 100738906

IUPAC2-(7-chloro-4-oxoquinolin-1-yl)-N,N-diethylacetamide
SMILESCCN(CC)C(=O)Cn1ccc(=O)c2ccc(Cl)cc21
InChIInChI=1S/C15H17ClN2O2/c1-3-17(4-2)15(20)10-18-8-7-14(19)12-6-5-11(16)9-13(12)18/h5-9H,3-4,10H2,1-2H3
InChIKeyFZKPUOUFSJLHLE-UHFFFAOYSA-N
MW292.77 g/mol
LogP2.52
Rot. Bonds4

About 2-(7-chloro-4-oxoquinolin-1-yl)-N,N-diethylacetamide

2-(7-chloro-4-oxoquinolin-1-yl)-N,N-diethylacetamide (PubChem CID 100738906) has the molecular formula C15H17ClN2O2 and a molecular weight of 292.77 g/mol. Its IUPAC name is 2-(7-chloro-4-oxoquinolin-1-yl)-N,N-diethylacetamide.

Molecular Properties

Compound Name2-(7-chloro-4-oxoquinolin-1-yl)-N,N-diethylacetamide
PubChem CID100738906
Molecular FormulaC15H17ClN2O2
Molecular Weight292.77 g/mol
Exact Mass292.10
IUPAC Name2-(7-chloro-4-oxoquinolin-1-yl)-N,N-diethylacetamide
SMILESCCN(CC)C(=O)Cn1ccc(=O)c2ccc(Cl)cc21
InChIInChI=1S/C15H17ClN2O2/c1-3-17(4-2)15(20)10-18-8-7-14(19)12-6-5-11(16)9-13(12)18/h5-9H,3-4,10H2,1-2H3
InChIKeyFZKPUOUFSJLHLE-UHFFFAOYSA-N
XLogP2.52
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.77
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-acetyl-6-chloroindol-1-yl)-N,N-diethylacetamide
CID 143500326
2-(7-chloro-4-oxoquinolin-1-yl)-N-(4-chlorophenyl)acetamide
CID 100738455
2-(7-chloro-4-oxoquinolin-1-yl)-N-(2,6-diethylphenyl)acetamide
CID 100739307
N-(4-butylphenyl)-2-(7-chloro-4-oxoquinolin-1-yl)acetamide
CID 100739255
2-(7-chloro-4-oxoquinolin-1-yl)-N-(2-ethoxyphenyl)acetamide
CID 100738706
3-(7-chloro-4-oxoquinolin-1-yl)propanoic acid
CID 53264256
2-(4,6-dichloroindol-1-yl)-N-ethyl-N-methylacetamide
CID 103428284
N,N-diethyl-2-(4-fluoroindol-1-yl)acetamide
CID 82794493
2-(7-chloro-4-oxoquinolin-1-yl)-N-[(1S)-1-(4-fluorophenyl)ethyl]acetamide
CID 100739457
2-(4,6-dichloroindol-1-yl)-N,N-dimethylacetamide
CID 103428458
2-(7-chloro-4-oxoquinolin-1-yl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 100738649
N-(1,3-benzodioxol-5-ylmethyl)-2-(7-chloro-4-oxoquinolin-1-yl)acetamide
CID 100739164

Frequently Asked Questions

What is the IUPAC name of 2-(7-chloro-4-oxoquinolin-1-yl)-N,N-diethylacetamide?
The IUPAC name of 2-(7-chloro-4-oxoquinolin-1-yl)-N,N-diethylacetamide (CID 100738906) is 2-(7-chloro-4-oxoquinolin-1-yl)-N,N-diethylacetamide.
What is the SMILES notation for 2-(7-chloro-4-oxoquinolin-1-yl)-N,N-diethylacetamide?
The canonical SMILES for 2-(7-chloro-4-oxoquinolin-1-yl)-N,N-diethylacetamide is CCN(CC)C(=O)Cn1ccc(=O)c2ccc(Cl)cc21.
What is the InChIKey of 2-(7-chloro-4-oxoquinolin-1-yl)-N,N-diethylacetamide?
The InChIKey is FZKPUOUFSJLHLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2O2/c1-3-17(4-2)15(20)10-18-8-7-14(19)12-6-5-11(16)9-13(12)18/h5-9H,3-4,10H2,1-2H3.
What are the key properties of 2-(7-chloro-4-oxoquinolin-1-yl)-N,N-diethylacetamide?
2-(7-chloro-4-oxoquinolin-1-yl)-N,N-diethylacetamide has a molecular weight of 292.77 g/mol, XLogP of 2.52, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-chloro-4-oxoquinolin-1-yl)-N,N-diethylacetamide is sourced from PubChem (CID 100738906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).