N,N-diethyl-2-(3-methyl-4-oxopiperidin-1-yl)propanamide

C13H24N2O2 — CID 114500324

IUPACN,N-diethyl-2-(3-methyl-4-oxopiperidin-1-yl)propanamide
SMILESCCN(CC)C(=O)C(C)N1CCC(=O)C(C)C1
InChIInChI=1S/C13H24N2O2/c1-5-14(6-2)13(17)11(4)15-8-7-12(16)10(3)9-15/h10-11H,5-9H2,1-4H3
InChIKeyWUJKMTCCWABJSG-UHFFFAOYSA-N
MW240.35 g/mol
LogP1.15
Rot. Bonds4

About N,N-diethyl-2-(3-methyl-4-oxopiperidin-1-yl)propanamide

N,N-diethyl-2-(3-methyl-4-oxopiperidin-1-yl)propanamide (PubChem CID 114500324) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is N,N-diethyl-2-(3-methyl-4-oxopiperidin-1-yl)propanamide.

Molecular Properties

Compound NameN,N-diethyl-2-(3-methyl-4-oxopiperidin-1-yl)propanamide
PubChem CID114500324
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC NameN,N-diethyl-2-(3-methyl-4-oxopiperidin-1-yl)propanamide
SMILESCCN(CC)C(=O)C(C)N1CCC(=O)C(C)C1
InChIInChI=1S/C13H24N2O2/c1-5-14(6-2)13(17)11(4)15-8-7-12(16)10(3)9-15/h10-11H,5-9H2,1-4H3
InChIKeyWUJKMTCCWABJSG-UHFFFAOYSA-N
XLogP1.15
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methyl-4-oxopiperidin-1-yl)propanoic acid
CID 114500310
2-(3-methyl-4-oxopiperidin-1-yl)-N-(2-methylpropyl)propanamide
CID 114500457
2-(3,5-dimethylpiperazin-1-yl)-N,N-diethylpropanamide
CID 63874454
2-(4-amino-3-methylpiperidin-1-yl)-N,N-diethylpropanamide
CID 79867648
N,N-diethyl-2-[3-methyl-4-(methylamino)piperidin-1-yl]propanamide
CID 114499097
N,N-diethyl-2-[4-(ethylamino)-3-methylpiperidin-1-yl]propanamide
CID 114499277
2-[3-(aminomethyl)piperidin-1-yl]-N,N-diethylpropanamide
CID 55210780
methyl 1-[1-(diethylamino)-1-oxopropan-2-yl]pyrrolidine-3-carboxylate
CID 112730779
methyl 1-[1-(diethylamino)-1-oxopropan-2-yl]piperidine-3-carboxylate
CID 78920382
2-[3-(2-aminoethyl)piperidin-1-yl]-N,N-diethylpropanamide;hydrochloride
CID 120728523
2-[2-(aminomethyl)-6-methylmorpholin-4-yl]-N,N-diethylpropanamide
CID 102938763
2-[(3S,4R)-3-amino-4-phenylpyrrolidin-1-yl]-N,N-diethylpropanamide
CID 120760495

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-(3-methyl-4-oxopiperidin-1-yl)propanamide?
The IUPAC name of N,N-diethyl-2-(3-methyl-4-oxopiperidin-1-yl)propanamide (CID 114500324) is N,N-diethyl-2-(3-methyl-4-oxopiperidin-1-yl)propanamide.
What is the SMILES notation for N,N-diethyl-2-(3-methyl-4-oxopiperidin-1-yl)propanamide?
The canonical SMILES for N,N-diethyl-2-(3-methyl-4-oxopiperidin-1-yl)propanamide is CCN(CC)C(=O)C(C)N1CCC(=O)C(C)C1.
What is the InChIKey of N,N-diethyl-2-(3-methyl-4-oxopiperidin-1-yl)propanamide?
The InChIKey is WUJKMTCCWABJSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-5-14(6-2)13(17)11(4)15-8-7-12(16)10(3)9-15/h10-11H,5-9H2,1-4H3.
What are the key properties of N,N-diethyl-2-(3-methyl-4-oxopiperidin-1-yl)propanamide?
N,N-diethyl-2-(3-methyl-4-oxopiperidin-1-yl)propanamide has a molecular weight of 240.35 g/mol, XLogP of 1.15, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-(3-methyl-4-oxopiperidin-1-yl)propanamide is sourced from PubChem (CID 114500324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).