N-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-2-oxoacetamide

C11H20N4O3 — CID 108509776

IUPACN-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-2-oxoacetamide
SMILESCN1CCN(NC(=O)C(=O)N2CCOCC2)CC1
InChIInChI=1S/C11H20N4O3/c1-13-2-4-15(5-3-13)12-10(16)11(17)14-6-8-18-9-7-14/h2-9H2,1H3,(H,12,16)
InChIKeyRTOXXKXFQNVQPF-UHFFFAOYSA-N
MW256.31 g/mol
LogP-1.88
Rot. Bonds1

About N-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-2-oxoacetamide

N-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-2-oxoacetamide (PubChem CID 108509776) has the molecular formula C11H20N4O3 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-2-oxoacetamide.

Molecular Properties

Compound NameN-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-2-oxoacetamide
PubChem CID108509776
Molecular FormulaC11H20N4O3
Molecular Weight256.31 g/mol
Exact Mass256.15
IUPAC NameN-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-2-oxoacetamide
SMILESCN1CCN(NC(=O)C(=O)N2CCOCC2)CC1
InChIInChI=1S/C11H20N4O3/c1-13-2-4-15(5-3-13)12-10(16)11(17)14-6-8-18-9-7-14/h2-9H2,1H3,(H,12,16)
InChIKeyRTOXXKXFQNVQPF-UHFFFAOYSA-N
XLogP-1.88
TPSA65.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 5-1.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-2-oxoacetamide?
The IUPAC name of N-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-2-oxoacetamide (CID 108509776) is N-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-2-oxoacetamide.
What is the SMILES notation for N-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-2-oxoacetamide?
The canonical SMILES for N-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-2-oxoacetamide is CN1CCN(NC(=O)C(=O)N2CCOCC2)CC1.
What is the InChIKey of N-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-2-oxoacetamide?
The InChIKey is RTOXXKXFQNVQPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O3/c1-13-2-4-15(5-3-13)12-10(16)11(17)14-6-8-18-9-7-14/h2-9H2,1H3,(H,12,16).
What are the key properties of N-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-2-oxoacetamide?
N-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-2-oxoacetamide has a molecular weight of 256.31 g/mol, XLogP of -1.88, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpiperazin-1-yl)-2-morpholin-4-yl-2-oxoacetamide is sourced from PubChem (CID 108509776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).