N-(2-ethylquinolin-4-yl)-4-methyl-2-oxopiperidine-4-carboxamide

C18H21N3O2 — CID 136570287

IUPACN-(2-ethylquinolin-4-yl)-4-methyl-2-oxopiperidine-4-carboxamide
SMILESCCc1cc(NC(=O)C2(C)CCNC(=O)C2)c2ccccc2n1
InChIInChI=1S/C18H21N3O2/c1-3-12-10-15(13-6-4-5-7-14(13)20-12)21-17(23)18(2)8-9-19-16(22)11-18/h4-7,10H,3,8-9,11H2,1-2H3,(H,19,22)(H,20,21,23)
InChIKeyAIPJRCRVWOPOCV-UHFFFAOYSA-N
MW311.39 g/mol
LogP2.65
Rot. Bonds3

About N-(2-ethylquinolin-4-yl)-4-methyl-2-oxopiperidine-4-carboxamide

N-(2-ethylquinolin-4-yl)-4-methyl-2-oxopiperidine-4-carboxamide (PubChem CID 136570287) has the molecular formula C18H21N3O2 and a molecular weight of 311.39 g/mol. Its IUPAC name is N-(2-ethylquinolin-4-yl)-4-methyl-2-oxopiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-ethylquinolin-4-yl)-4-methyl-2-oxopiperidine-4-carboxamide
PubChem CID136570287
Molecular FormulaC18H21N3O2
Molecular Weight311.39 g/mol
Exact Mass311.16
IUPAC NameN-(2-ethylquinolin-4-yl)-4-methyl-2-oxopiperidine-4-carboxamide
SMILESCCc1cc(NC(=O)C2(C)CCNC(=O)C2)c2ccccc2n1
InChIInChI=1S/C18H21N3O2/c1-3-12-10-15(13-6-4-5-7-14(13)20-12)21-17(23)18(2)8-9-19-16(22)11-18/h4-7,10H,3,8-9,11H2,1-2H3,(H,19,22)(H,20,21,23)
InChIKeyAIPJRCRVWOPOCV-UHFFFAOYSA-N
XLogP2.65
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,4-dioxo-1,3-diazinan-1-yl)-N-(2-ethylquinolin-4-yl)acetamide
CID 122143050
4-[[(2-ethylquinolin-4-yl)amino]methyl]oxane-4-carboxamide
CID 133430578
1-(2-ethylquinolin-4-yl)-3-[1-(3-methyl-1,2,4-oxadiazol-5-yl)cyclopropyl]urea
CID 146109489
1-(2-ethylquinolin-4-yl)-3-[(1S)-1-(1H-1,2,4-triazol-5-yl)ethyl]urea
CID 124728310
2-(1,1-dioxothiolan-3-yl)-N-(2-ethylquinolin-4-yl)acetamide
CID 75521076
1-(2-ethylquinolin-4-yl)-3-[2-(3-methyl-2-pyridinyl)ethyl]urea
CID 146095631
N-(2-ethylquinolin-4-yl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide
CID 75518287
3-(cyclopropanecarbonylamino)-N-(2-ethylquinolin-4-yl)azetidine-1-carboxamide
CID 128543542
2-[(2-ethylquinolin-4-yl)amino]-1-(oxan-4-yl)ethanol
CID 133402118
N-(2-ethylquinolin-4-yl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
CID 75450815
5-[(2-ethylquinolin-4-yl)amino]-4-methylpentan-2-ol
CID 133402239
4-ethyl-N-quinolin-5-ylpiperidine-4-carboxamide
CID 63127284

Frequently Asked Questions

What is the IUPAC name of N-(2-ethylquinolin-4-yl)-4-methyl-2-oxopiperidine-4-carboxamide?
The IUPAC name of N-(2-ethylquinolin-4-yl)-4-methyl-2-oxopiperidine-4-carboxamide (CID 136570287) is N-(2-ethylquinolin-4-yl)-4-methyl-2-oxopiperidine-4-carboxamide.
What is the SMILES notation for N-(2-ethylquinolin-4-yl)-4-methyl-2-oxopiperidine-4-carboxamide?
The canonical SMILES for N-(2-ethylquinolin-4-yl)-4-methyl-2-oxopiperidine-4-carboxamide is CCc1cc(NC(=O)C2(C)CCNC(=O)C2)c2ccccc2n1.
What is the InChIKey of N-(2-ethylquinolin-4-yl)-4-methyl-2-oxopiperidine-4-carboxamide?
The InChIKey is AIPJRCRVWOPOCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2/c1-3-12-10-15(13-6-4-5-7-14(13)20-12)21-17(23)18(2)8-9-19-16(22)11-18/h4-7,10H,3,8-9,11H2,1-2H3,(H,19,22)(H,20,21,23).
What are the key properties of N-(2-ethylquinolin-4-yl)-4-methyl-2-oxopiperidine-4-carboxamide?
N-(2-ethylquinolin-4-yl)-4-methyl-2-oxopiperidine-4-carboxamide has a molecular weight of 311.39 g/mol, XLogP of 2.65, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethylquinolin-4-yl)-4-methyl-2-oxopiperidine-4-carboxamide is sourced from PubChem (CID 136570287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).