N,N-diethyl-4-[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]piperidine-1-carboxamide

C18H32N4O3 — CID 108560686

IUPACN,N-diethyl-4-[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]piperidine-1-carboxamide
SMILESCCN(CC)C(=O)N1CCC(NC(=O)C2CC(=O)N(C(C)C)C2)CC1
InChIInChI=1S/C18H32N4O3/c1-5-20(6-2)18(25)21-9-7-15(8-10-21)19-17(24)14-11-16(23)22(12-14)13(3)4/h13-15H,5-12H2,1-4H3,(H,19,24)
InChIKeyUHONIVWUZUQPIJ-UHFFFAOYSA-N
MW352.48 g/mol
LogP1.29
Rot. Bonds5

About N,N-diethyl-4-[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]piperidine-1-carboxamide

N,N-diethyl-4-[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]piperidine-1-carboxamide (PubChem CID 108560686) has the molecular formula C18H32N4O3 and a molecular weight of 352.48 g/mol. Its IUPAC name is N,N-diethyl-4-[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]piperidine-1-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-4-[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]piperidine-1-carboxamide
PubChem CID108560686
Molecular FormulaC18H32N4O3
Molecular Weight352.48 g/mol
Exact Mass352.25
IUPAC NameN,N-diethyl-4-[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]piperidine-1-carboxamide
SMILESCCN(CC)C(=O)N1CCC(NC(=O)C2CC(=O)N(C(C)C)C2)CC1
InChIInChI=1S/C18H32N4O3/c1-5-20(6-2)18(25)21-9-7-15(8-10-21)19-17(24)14-11-16(23)22(12-14)13(3)4/h13-15H,5-12H2,1-4H3,(H,19,24)
InChIKeyUHONIVWUZUQPIJ-UHFFFAOYSA-N
XLogP1.29
TPSA72.96 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.48
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-tert-butyl-5-oxo-N-[1-(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)piperidin-4-yl]pyrrolidine-3-carboxamide
CID 108552376
N-[1-(2-chlorobenzoyl)piperidin-4-yl]-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 108552516
N-[1-[2-(2-ethoxyphenoxy)acetyl]piperidin-4-yl]-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 108552532
N-[1-[2-(2-ethylphenoxy)acetyl]piperidin-4-yl]-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 108552579
2,2-dichloro-N-[1-(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)piperidin-4-yl]acetamide
CID 108564919
N-[1-(3,4-dimethoxybenzoyl)piperidin-4-yl]-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 108552495
5-oxo-N-(6-oxopiperidin-3-yl)-1-propan-2-ylpyrrolidine-3-carboxamide
CID 62896987
N-[1-(2,3-dimethylquinoxaline-6-carbonyl)piperidin-4-yl]-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 108552552
4-chloro-N-[1-(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)piperidin-4-yl]butanamide
CID 108564916
4-(2,2-dimethylpropanoylamino)-N,N-diethylpiperidine-1-carboxamide
CID 3694430
N-[1-(2,4-dimethylphenyl)sulfonylpiperidin-4-yl]-5-oxo-1-propan-2-ylpyrrolidine-3-carboxamide
CID 108560662
(3R)-5-oxo-N-[(3S)-2-oxothiolan-3-yl]-1-propan-2-ylpyrrolidine-3-carboxamide
CID 9400945

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]piperidine-1-carboxamide?
The IUPAC name of N,N-diethyl-4-[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]piperidine-1-carboxamide (CID 108560686) is N,N-diethyl-4-[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]piperidine-1-carboxamide.
What is the SMILES notation for N,N-diethyl-4-[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]piperidine-1-carboxamide?
The canonical SMILES for N,N-diethyl-4-[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]piperidine-1-carboxamide is CCN(CC)C(=O)N1CCC(NC(=O)C2CC(=O)N(C(C)C)C2)CC1.
What is the InChIKey of N,N-diethyl-4-[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]piperidine-1-carboxamide?
The InChIKey is UHONIVWUZUQPIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H32N4O3/c1-5-20(6-2)18(25)21-9-7-15(8-10-21)19-17(24)14-11-16(23)22(12-14)13(3)4/h13-15H,5-12H2,1-4H3,(H,19,24).
What are the key properties of N,N-diethyl-4-[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]piperidine-1-carboxamide?
N,N-diethyl-4-[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]piperidine-1-carboxamide has a molecular weight of 352.48 g/mol, XLogP of 1.29, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-[(5-oxo-1-propan-2-ylpyrrolidine-3-carbonyl)amino]piperidine-1-carboxamide is sourced from PubChem (CID 108560686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).