N-(2,6-diethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide

C23H26N2O2 — CID 39763943

IUPACN-(2,6-diethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide
SMILESCCc1cccc(CC)c1NC(=O)CCn1c(=O)cc(C)c2ccccc21
InChIInChI=1S/C23H26N2O2/c1-4-17-9-8-10-18(5-2)23(17)24-21(26)13-14-25-20-12-7-6-11-19(20)16(3)15-22(25)27/h6-12,15H,4-5,13-14H2,1-3H3,(H,24,26)
InChIKeyVWQHNGMYVBHBNT-UHFFFAOYSA-N
MW362.47 g/mol
LogP4.46
Rot. Bonds6

About N-(2,6-diethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide

N-(2,6-diethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide (PubChem CID 39763943) has the molecular formula C23H26N2O2 and a molecular weight of 362.47 g/mol. Its IUPAC name is N-(2,6-diethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide.

Molecular Properties

Compound NameN-(2,6-diethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide
PubChem CID39763943
Molecular FormulaC23H26N2O2
Molecular Weight362.47 g/mol
Exact Mass362.20
IUPAC NameN-(2,6-diethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide
SMILESCCc1cccc(CC)c1NC(=O)CCn1c(=O)cc(C)c2ccccc21
InChIInChI=1S/C23H26N2O2/c1-4-17-9-8-10-18(5-2)23(17)24-21(26)13-14-25-20-12-7-6-11-19(20)16(3)15-22(25)27/h6-12,15H,4-5,13-14H2,1-3H3,(H,24,26)
InChIKeyVWQHNGMYVBHBNT-UHFFFAOYSA-N
XLogP4.46
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide
CID 39763926
3-(4-methyl-2-oxoquinolin-1-yl)-N-phenylpropanamide
CID 39763922
4-methyl-1-(3-oxobutyl)quinolin-2-one
CID 919960
N-(2,5-dichlorophenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide
CID 39763973
N-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide
CID 39763982
N-(3-cyano-4,5-dimethylfuran-2-yl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide
CID 39764289
N-(2,6-diethylphenyl)-3-(3,4-dimethyl-6-oxo-1-phenylpyrazolo[5,4-b]pyridin-7-yl)propanamide
CID 46306737
N-(2,6-dimethylphenyl)-3-(8-methoxy-4-methyl-2-oxoquinolin-1-yl)propanamide
CID 39765352
N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-3-(4-methyl-2-oxoquinolin-1-yl)propanamide
CID 46969091
3-(1,3-dioxoisoindol-2-yl)-N-(2-ethyl-6-methylphenyl)propanamide
CID 723292
methyl 2-(4-methyl-2-oxoquinolin-1-yl)acetate
CID 39767914
N-(2,6-diethylphenyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide
CID 18089552

Frequently Asked Questions

What is the IUPAC name of N-(2,6-diethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide?
The IUPAC name of N-(2,6-diethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide (CID 39763943) is N-(2,6-diethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide.
What is the SMILES notation for N-(2,6-diethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide?
The canonical SMILES for N-(2,6-diethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide is CCc1cccc(CC)c1NC(=O)CCn1c(=O)cc(C)c2ccccc21.
What is the InChIKey of N-(2,6-diethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide?
The InChIKey is VWQHNGMYVBHBNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O2/c1-4-17-9-8-10-18(5-2)23(17)24-21(26)13-14-25-20-12-7-6-11-19(20)16(3)15-22(25)27/h6-12,15H,4-5,13-14H2,1-3H3,(H,24,26).
What are the key properties of N-(2,6-diethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide?
N-(2,6-diethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide has a molecular weight of 362.47 g/mol, XLogP of 4.46, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-diethylphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide is sourced from PubChem (CID 39763943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).