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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Related Compounds

1-acetyl-N-methylpiperazine-2-carboxamide;hydrochloride
CID 171688200
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CID 83193491
1-(2-cyclopropylpropanoyl)-N-methylpiperazine-2-carboxamide
CID 83149686
N-methyl-1-(4-methylpiperidine-1-carbonyl)piperazine-2-carboxamide
CID 79162942
(2-benzylpiperazin-1-yl)-(oxolan-2-yl)methanone
CID 82247957
(2S)-1-(4-fluorobenzoyl)-N-methylpiperazine-2-carboxamide
CID 124513939
oxolan-2-yl-(2-piperidin-3-ylpyrrolidin-1-yl)methanone
CID 54885653
1-(3,5-dibromobenzoyl)-N-methylpiperazine-2-carboxamide
CID 107973359
2-methyl-1-[(2S)-1-[(2R)-oxolane-2-carbonyl]pyrrolidin-2-yl]propan-1-one
CID 59266604
(2-methyl-1,3-oxazinan-3-yl)-(oxolan-2-yl)methanone
CID 110739759
1-(4-chloro-2,5-difluorobenzoyl)-N-methylpiperazine-2-carboxamide
CID 82772342

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).