3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N,N-diethylpropanamide

C18H24N2O2 — CID 110331658

IUPAC3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)CCc1cc2cc(C)c(C)cc2[nH]c1=O
InChIInChI=1S/C18H24N2O2/c1-5-20(6-2)17(21)8-7-14-11-15-9-12(3)13(4)10-16(15)19-18(14)22/h9-11H,5-8H2,1-4H3,(H,19,22)
InChIKeyUGAUYXURQCFXPK-UHFFFAOYSA-N
MW300.40 g/mol
LogP2.95
Rot. Bonds5

About 3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N,N-diethylpropanamide

3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N,N-diethylpropanamide (PubChem CID 110331658) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is 3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N,N-diethylpropanamide.

Molecular Properties

Compound Name3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N,N-diethylpropanamide
PubChem CID110331658
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC Name3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)CCc1cc2cc(C)c(C)cc2[nH]c1=O
InChIInChI=1S/C18H24N2O2/c1-5-20(6-2)17(21)8-7-14-11-15-9-12(3)13(4)10-16(15)19-18(14)22/h9-11H,5-8H2,1-4H3,(H,19,22)
InChIKeyUGAUYXURQCFXPK-UHFFFAOYSA-N
XLogP2.95
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-diethyl-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)propanamide
CID 53174783
N-benzyl-3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide
CID 110331632
3-ethyl-6,7-dimethyl-1H-quinolin-2-one
CID 21061119
3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N-propan-2-ylpropanamide
CID 110331604
N-[2-(dimethylamino)ethyl]-3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331619
N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]acetamide
CID 3240947
3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N-prop-2-enylpropanamide
CID 110331606
3-(ethylaminomethyl)-6,7-dimethyl-1H-quinolin-2-one
CID 23009284
N-benzyl-3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331627
3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N-[(4-fluorophenyl)methyl]propanamide
CID 110331634
3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N-[2-(4-fluorophenyl)ethyl]propanamide
CID 110331644
N-[2-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)ethyl]-2-methylbenzamide
CID 4077939

Frequently Asked Questions

What is the IUPAC name of 3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N,N-diethylpropanamide?
The IUPAC name of 3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N,N-diethylpropanamide (CID 110331658) is 3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N,N-diethylpropanamide.
What is the SMILES notation for 3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N,N-diethylpropanamide?
The canonical SMILES for 3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N,N-diethylpropanamide is CCN(CC)C(=O)CCc1cc2cc(C)c(C)cc2[nH]c1=O.
What is the InChIKey of 3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N,N-diethylpropanamide?
The InChIKey is UGAUYXURQCFXPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-5-20(6-2)17(21)8-7-14-11-15-9-12(3)13(4)10-16(15)19-18(14)22/h9-11H,5-8H2,1-4H3,(H,19,22).
What are the key properties of 3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N,N-diethylpropanamide?
3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N,N-diethylpropanamide has a molecular weight of 300.40 g/mol, XLogP of 2.95, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)-N,N-diethylpropanamide is sourced from PubChem (CID 110331658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).