N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-2-carboxamide;hydrochloride

C12H22ClN3O3 — CID 119260081

IUPACN-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-2-carboxamide;hydrochloride
SMILESCN(CC(=O)N1CCNCC1)C(=O)C1CCCO1.Cl
InChIInChI=1S/C12H21N3O3.ClH/c1-14(12(17)10-3-2-8-18-10)9-11(16)15-6-4-13-5-7-15;/h10,13H,2-9H2,1H3;1H
InChIKeyPIDGSOLCLCKTOA-UHFFFAOYSA-N
MW291.78 g/mol
LogP-0.52
Rot. Bonds3

About N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-2-carboxamide;hydrochloride

N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-2-carboxamide;hydrochloride (PubChem CID 119260081) has the molecular formula C12H22ClN3O3 and a molecular weight of 291.78 g/mol. Its IUPAC name is N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-2-carboxamide;hydrochloride
PubChem CID119260081
Molecular FormulaC12H22ClN3O3
Molecular Weight291.78 g/mol
Exact Mass291.13
IUPAC NameN-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-2-carboxamide;hydrochloride
SMILESCN(CC(=O)N1CCNCC1)C(=O)C1CCCO1.Cl
InChIInChI=1S/C12H21N3O3.ClH/c1-14(12(17)10-3-2-8-18-10)9-11(16)15-6-4-13-5-7-15;/h10,13H,2-9H2,1H3;1H
InChIKeyPIDGSOLCLCKTOA-UHFFFAOYSA-N
XLogP-0.52
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.78
LogP ≤ 5-0.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-2-carboxamide;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxane-2-carboxamide
CID 62214583
(2S)-N-methyl-N-(2-piperazin-1-ylethyl)oxolane-2-carboxamide
CID 104856250
N-methyl-N-(2-piperazin-1-ylethyl)oxolane-2-carboxamide
CID 63265290
N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)cyclohexanecarboxamide
CID 43603207
N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)-2-phenyloxane-3-carboxamide
CID 119454627
N-methyl-N-piperidin-4-yloxolane-2-carboxamide;hydrochloride
CID 119260019
N-methyl-N-(2-morpholin-4-yl-2-oxoethyl)piperidine-3-carboxamide;hydrochloride
CID 119290915
2-[methyl(oxan-4-yl)amino]-1-piperazin-1-ylethanone
CID 43611217
N-methyl-N-(2-oxo-2-pyrrolidin-1-ylethyl)pyrrolidine-3-carboxamide
CID 63005448
2-(dimethylamino)-1-piperazin-1-ylethanone
CID 16770302
N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)propanamide
CID 43603133
N-(2-hydroxypropyl)-N-methyloxolane-2-carboxamide
CID 62335321

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-2-carboxamide;hydrochloride?
The IUPAC name of N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-2-carboxamide;hydrochloride (CID 119260081) is N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-2-carboxamide;hydrochloride.
What is the SMILES notation for N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-2-carboxamide;hydrochloride?
The canonical SMILES for N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-2-carboxamide;hydrochloride is CN(CC(=O)N1CCNCC1)C(=O)C1CCCO1.Cl.
What is the InChIKey of N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-2-carboxamide;hydrochloride?
The InChIKey is PIDGSOLCLCKTOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O3.ClH/c1-14(12(17)10-3-2-8-18-10)9-11(16)15-6-4-13-5-7-15;/h10,13H,2-9H2,1H3;1H.
What are the key properties of N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-2-carboxamide;hydrochloride?
N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-2-carboxamide;hydrochloride has a molecular weight of 291.78 g/mol, XLogP of -0.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(2-oxo-2-piperazin-1-ylethyl)oxolane-2-carboxamide;hydrochloride is sourced from PubChem (CID 119260081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).