N,N-dimethyl-4-(5-oxo-1-propylpyrrolidine-3-carbonyl)piperazine-1-carboxamide

C15H26N4O3 — CID 110346275

IUPACN,N-dimethyl-4-(5-oxo-1-propylpyrrolidine-3-carbonyl)piperazine-1-carboxamide
SMILESCCCN1CC(C(=O)N2CCN(C(=O)N(C)C)CC2)CC1=O
InChIInChI=1S/C15H26N4O3/c1-4-5-19-11-12(10-13(19)20)14(21)17-6-8-18(9-7-17)15(22)16(2)3/h12H,4-11H2,1-3H3
InChIKeyWZLURFBMUAWWSR-UHFFFAOYSA-N
MW310.40 g/mol
LogP0.07
Rot. Bonds3

About N,N-dimethyl-4-(5-oxo-1-propylpyrrolidine-3-carbonyl)piperazine-1-carboxamide

N,N-dimethyl-4-(5-oxo-1-propylpyrrolidine-3-carbonyl)piperazine-1-carboxamide (PubChem CID 110346275) has the molecular formula C15H26N4O3 and a molecular weight of 310.40 g/mol. Its IUPAC name is N,N-dimethyl-4-(5-oxo-1-propylpyrrolidine-3-carbonyl)piperazine-1-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-4-(5-oxo-1-propylpyrrolidine-3-carbonyl)piperazine-1-carboxamide
PubChem CID110346275
Molecular FormulaC15H26N4O3
Molecular Weight310.40 g/mol
Exact Mass310.20
IUPAC NameN,N-dimethyl-4-(5-oxo-1-propylpyrrolidine-3-carbonyl)piperazine-1-carboxamide
SMILESCCCN1CC(C(=O)N2CCN(C(=O)N(C)C)CC2)CC1=O
InChIInChI=1S/C15H26N4O3/c1-4-5-19-11-12(10-13(19)20)14(21)17-6-8-18(9-7-17)15(22)16(2)3/h12H,4-11H2,1-3H3
InChIKeyWZLURFBMUAWWSR-UHFFFAOYSA-N
XLogP0.07
TPSA64.17 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 50.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-(5-oxo-1-propylpyrrolidine-3-carbonyl)piperazine-1-carboxamide?
The IUPAC name of N,N-dimethyl-4-(5-oxo-1-propylpyrrolidine-3-carbonyl)piperazine-1-carboxamide (CID 110346275) is N,N-dimethyl-4-(5-oxo-1-propylpyrrolidine-3-carbonyl)piperazine-1-carboxamide.
What is the SMILES notation for N,N-dimethyl-4-(5-oxo-1-propylpyrrolidine-3-carbonyl)piperazine-1-carboxamide?
The canonical SMILES for N,N-dimethyl-4-(5-oxo-1-propylpyrrolidine-3-carbonyl)piperazine-1-carboxamide is CCCN1CC(C(=O)N2CCN(C(=O)N(C)C)CC2)CC1=O.
What is the InChIKey of N,N-dimethyl-4-(5-oxo-1-propylpyrrolidine-3-carbonyl)piperazine-1-carboxamide?
The InChIKey is WZLURFBMUAWWSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O3/c1-4-5-19-11-12(10-13(19)20)14(21)17-6-8-18(9-7-17)15(22)16(2)3/h12H,4-11H2,1-3H3.
What are the key properties of N,N-dimethyl-4-(5-oxo-1-propylpyrrolidine-3-carbonyl)piperazine-1-carboxamide?
N,N-dimethyl-4-(5-oxo-1-propylpyrrolidine-3-carbonyl)piperazine-1-carboxamide has a molecular weight of 310.40 g/mol, XLogP of 0.07, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-(5-oxo-1-propylpyrrolidine-3-carbonyl)piperazine-1-carboxamide is sourced from PubChem (CID 110346275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).