N,N-diethyl-3-(3-methyl-2-oxoquinolin-1-yl)propanamide

C17H22N2O2 — CID 110680260

IUPACN,N-diethyl-3-(3-methyl-2-oxoquinolin-1-yl)propanamide
SMILESCCN(CC)C(=O)CCn1c(=O)c(C)cc2ccccc21
InChIInChI=1S/C17H22N2O2/c1-4-18(5-2)16(20)10-11-19-15-9-7-6-8-14(15)12-13(3)17(19)21/h6-9,12H,4-5,10-11H2,1-3H3
InChIKeySPEXCBXTFYVKMC-UHFFFAOYSA-N
MW286.38 g/mol
LogP2.57
Rot. Bonds5

About N,N-diethyl-3-(3-methyl-2-oxoquinolin-1-yl)propanamide

N,N-diethyl-3-(3-methyl-2-oxoquinolin-1-yl)propanamide (PubChem CID 110680260) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is N,N-diethyl-3-(3-methyl-2-oxoquinolin-1-yl)propanamide.

Molecular Properties

Compound NameN,N-diethyl-3-(3-methyl-2-oxoquinolin-1-yl)propanamide
PubChem CID110680260
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC NameN,N-diethyl-3-(3-methyl-2-oxoquinolin-1-yl)propanamide
SMILESCCN(CC)C(=O)CCn1c(=O)c(C)cc2ccccc21
InChIInChI=1S/C17H22N2O2/c1-4-18(5-2)16(20)10-11-19-15-9-7-6-8-14(15)12-13(3)17(19)21/h6-9,12H,4-5,10-11H2,1-3H3
InChIKeySPEXCBXTFYVKMC-UHFFFAOYSA-N
XLogP2.57
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(4-acetylpiperazin-1-yl)-3-oxopropyl]-3-methylquinolin-2-one
CID 110680239
N-[2-(dimethylamino)ethyl]-3-(3-methyl-2-oxoquinolin-1-yl)propanamide
CID 110680233
ethane;1-ethyl-3-methylquinolin-2-one
CID 142177817
N-(2-acetamidoethyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide
CID 110680262
3-(3-methyl-2-oxoquinolin-1-yl)-N-pyrimidin-2-ylpropanamide
CID 110680287
3-methyl-1-[3-(4-methylpiperidin-1-yl)-3-oxopropyl]quinolin-2-one
CID 110680227
N-(3-acetylphenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide
CID 110680283
N-(3,4-difluorophenyl)-3-(3-methyl-2-oxoquinolin-1-yl)propanamide
CID 110680300
2-(3-methyl-2-oxoquinolin-1-yl)-N-(4-methylphenyl)acetamide
CID 110680370
2-(3-fluorophenyl)-N-[2-(3-methyl-2-oxoquinolin-1-yl)ethyl]acetamide
CID 110707094
N-benzyl-N-ethyl-3-(3-methyl-2-oxobenzimidazol-1-yl)propanamide
CID 18134876
methyl 2-[ethyl-[2-(2-methylindol-1-yl)acetyl]amino]acetate
CID 61383658

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-3-(3-methyl-2-oxoquinolin-1-yl)propanamide?
The IUPAC name of N,N-diethyl-3-(3-methyl-2-oxoquinolin-1-yl)propanamide (CID 110680260) is N,N-diethyl-3-(3-methyl-2-oxoquinolin-1-yl)propanamide.
What is the SMILES notation for N,N-diethyl-3-(3-methyl-2-oxoquinolin-1-yl)propanamide?
The canonical SMILES for N,N-diethyl-3-(3-methyl-2-oxoquinolin-1-yl)propanamide is CCN(CC)C(=O)CCn1c(=O)c(C)cc2ccccc21.
What is the InChIKey of N,N-diethyl-3-(3-methyl-2-oxoquinolin-1-yl)propanamide?
The InChIKey is SPEXCBXTFYVKMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-4-18(5-2)16(20)10-11-19-15-9-7-6-8-14(15)12-13(3)17(19)21/h6-9,12H,4-5,10-11H2,1-3H3.
What are the key properties of N,N-diethyl-3-(3-methyl-2-oxoquinolin-1-yl)propanamide?
N,N-diethyl-3-(3-methyl-2-oxoquinolin-1-yl)propanamide has a molecular weight of 286.38 g/mol, XLogP of 2.57, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-3-(3-methyl-2-oxoquinolin-1-yl)propanamide is sourced from PubChem (CID 110680260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).