N-methyl-1-[(2R)-oxolane-2-carbonyl]piperazine-2-carboxamide

C11H19N3O3 — CID 104856345

IUPACN-methyl-1-[(2R)-oxolane-2-carbonyl]piperazine-2-carboxamide
SMILESCNC(=O)C1CNCCN1C(=O)[C@H]1CCCO1
InChIInChI=1S/C11H19N3O3/c1-12-10(15)8-7-13-4-5-14(8)11(16)9-3-2-6-17-9/h8-9,13H,2-7H2,1H3,(H,12,15)/t8?,9-/m1/s1
InChIKeyJLFNOLUIFUKZTM-YGPZHTELSA-N
MW241.29 g/mol
LogP-1.29
Rot. Bonds2

About N-methyl-1-[(2R)-oxolane-2-carbonyl]piperazine-2-carboxamide

N-methyl-1-[(2R)-oxolane-2-carbonyl]piperazine-2-carboxamide (PubChem CID 104856345) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is N-methyl-1-[(2R)-oxolane-2-carbonyl]piperazine-2-carboxamide.

Molecular Properties

Compound NameN-methyl-1-[(2R)-oxolane-2-carbonyl]piperazine-2-carboxamide
PubChem CID104856345
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC NameN-methyl-1-[(2R)-oxolane-2-carbonyl]piperazine-2-carboxamide
SMILESCNC(=O)C1CNCCN1C(=O)[C@H]1CCCO1
InChIInChI=1S/C11H19N3O3/c1-12-10(15)8-7-13-4-5-14(8)11(16)9-3-2-6-17-9/h8-9,13H,2-7H2,1H3,(H,12,15)/t8?,9-/m1/s1
InChIKeyJLFNOLUIFUKZTM-YGPZHTELSA-N
XLogP-1.29
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 5-1.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[(2R)-oxolane-2-carbonyl]piperazine-2-carboxamide?
The IUPAC name of N-methyl-1-[(2R)-oxolane-2-carbonyl]piperazine-2-carboxamide (CID 104856345) is N-methyl-1-[(2R)-oxolane-2-carbonyl]piperazine-2-carboxamide.
What is the SMILES notation for N-methyl-1-[(2R)-oxolane-2-carbonyl]piperazine-2-carboxamide?
The canonical SMILES for N-methyl-1-[(2R)-oxolane-2-carbonyl]piperazine-2-carboxamide is CNC(=O)C1CNCCN1C(=O)[C@H]1CCCO1.
What is the InChIKey of N-methyl-1-[(2R)-oxolane-2-carbonyl]piperazine-2-carboxamide?
The InChIKey is JLFNOLUIFUKZTM-YGPZHTELSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-12-10(15)8-7-13-4-5-14(8)11(16)9-3-2-6-17-9/h8-9,13H,2-7H2,1H3,(H,12,15)/t8?,9-/m1/s1.
What are the key properties of N-methyl-1-[(2R)-oxolane-2-carbonyl]piperazine-2-carboxamide?
N-methyl-1-[(2R)-oxolane-2-carbonyl]piperazine-2-carboxamide has a molecular weight of 241.29 g/mol, XLogP of -1.29, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[(2R)-oxolane-2-carbonyl]piperazine-2-carboxamide is sourced from PubChem (CID 104856345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).