N,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]piperidine-1-carboxamide

C15H28N4O2 — CID 83199504

IUPACN,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]piperidine-1-carboxamide
SMILESCN(C)C(=O)N1CCC(NCCC(=O)N2CCCC2)CC1
InChIInChI=1S/C15H28N4O2/c1-17(2)15(21)19-11-6-13(7-12-19)16-8-5-14(20)18-9-3-4-10-18/h13,16H,3-12H2,1-2H3
InChIKeyVVWMPHDNAACOHJ-UHFFFAOYSA-N
MW296.41 g/mol
LogP0.73
Rot. Bonds4

About N,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]piperidine-1-carboxamide

N,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]piperidine-1-carboxamide (PubChem CID 83199504) has the molecular formula C15H28N4O2 and a molecular weight of 296.41 g/mol. Its IUPAC name is N,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]piperidine-1-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]piperidine-1-carboxamide
PubChem CID83199504
Molecular FormulaC15H28N4O2
Molecular Weight296.41 g/mol
Exact Mass296.22
IUPAC NameN,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]piperidine-1-carboxamide
SMILESCN(C)C(=O)N1CCC(NCCC(=O)N2CCCC2)CC1
InChIInChI=1S/C15H28N4O2/c1-17(2)15(21)19-11-6-13(7-12-19)16-8-5-14(20)18-9-3-4-10-18/h13,16H,3-12H2,1-2H3
InChIKeyVVWMPHDNAACOHJ-UHFFFAOYSA-N
XLogP0.73
TPSA55.89 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]piperidine-1-carboxamide?
The IUPAC name of N,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]piperidine-1-carboxamide (CID 83199504) is N,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]piperidine-1-carboxamide.
What is the SMILES notation for N,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]piperidine-1-carboxamide?
The canonical SMILES for N,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]piperidine-1-carboxamide is CN(C)C(=O)N1CCC(NCCC(=O)N2CCCC2)CC1.
What is the InChIKey of N,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]piperidine-1-carboxamide?
The InChIKey is VVWMPHDNAACOHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O2/c1-17(2)15(21)19-11-6-13(7-12-19)16-8-5-14(20)18-9-3-4-10-18/h13,16H,3-12H2,1-2H3.
What are the key properties of N,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]piperidine-1-carboxamide?
N,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]piperidine-1-carboxamide has a molecular weight of 296.41 g/mol, XLogP of 0.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-[(3-oxo-3-pyrrolidin-1-ylpropyl)amino]piperidine-1-carboxamide is sourced from PubChem (CID 83199504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).