N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-(5-piperazin-1-yl-2-pyridinyl)acetamide

C17H23N5O3 — CID 155713621

IUPACN-(2,6-dioxopiperidin-3-yl)-N-methyl-2-(5-piperazin-1-yl-2-pyridinyl)acetamide
SMILESCN(C(=O)Cc1ccc(N2CCNCC2)cn1)C1CCC(=O)NC1=O
InChIInChI=1S/C17H23N5O3/c1-21(14-4-5-15(23)20-17(14)25)16(24)10-12-2-3-13(11-19-12)22-8-6-18-7-9-22/h2-3,11,14,18H,4-10H2,1H3,(H,20,23,25)
InChIKeyJBSRDECMXYMGFF-UHFFFAOYSA-N
MW345.40 g/mol
LogP-0.70
Rot. Bonds4

About N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-(5-piperazin-1-yl-2-pyridinyl)acetamide

N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-(5-piperazin-1-yl-2-pyridinyl)acetamide (PubChem CID 155713621) has the molecular formula C17H23N5O3 and a molecular weight of 345.40 g/mol. Its IUPAC name is N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-(5-piperazin-1-yl-2-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(2,6-dioxopiperidin-3-yl)-N-methyl-2-(5-piperazin-1-yl-2-pyridinyl)acetamide
PubChem CID155713621
Molecular FormulaC17H23N5O3
Molecular Weight345.40 g/mol
Exact Mass345.18
IUPAC NameN-(2,6-dioxopiperidin-3-yl)-N-methyl-2-(5-piperazin-1-yl-2-pyridinyl)acetamide
SMILESCN(C(=O)Cc1ccc(N2CCNCC2)cn1)C1CCC(=O)NC1=O
InChIInChI=1S/C17H23N5O3/c1-21(14-4-5-15(23)20-17(14)25)16(24)10-12-2-3-13(11-19-12)22-8-6-18-7-9-22/h2-3,11,14,18H,4-10H2,1H3,(H,20,23,25)
InChIKeyJBSRDECMXYMGFF-UHFFFAOYSA-N
XLogP-0.70
TPSA94.64 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 5-0.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

3-(N-methyl-4-piperazin-1-ylanilino)piperidine-2,6-dione;hydrochloride
CID 170749335
N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-(3-piperidin-1-yl-4-pyridinyl)acetamide
CID 164975599
N-(2,6-dioxopiperidin-3-yl)-2-[4-[4-[[1-[4-[(E)-1-(4-hydroxyphenyl)-2-phenylbut-1-enyl]phenyl]piperidin-4-yl]methyl]piperazin-1-yl]-2-pyridinyl]-N-methylacetamide
CID 155213483
(2S)-5-oxo-N-(5-piperazin-1-yl-2-pyridinyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119494514
N-(2,4-dioxocyclohexyl)-N-methyl-2-(5-piperazin-1-yl-3-pyridinyl)acetamide
CID 165087943
2-[(Z)-[(2,6-dioxopiperidin-3-yl)-methylhydrazinylidene]methyl]-4-piperazin-1-ylbenzaldehyde
CID 171564653
2-[1-[4-[(2,6-dioxopiperidin-3-yl)-methylamino]phenyl]piperidin-4-yl]acetaldehyde
CID 167470348
N-cyclohexyl-6-[4-[[4-[2-[2-[(2,6-dioxopiperidin-3-yl)-methylamino]-2-oxoethyl]-4-pyridinyl]piperazin-1-yl]methyl]piperidin-1-yl]pyridazine-3-carboxamide
CID 167164662
(Z)-N-(2,6-dioxopiperidin-3-yl)-N-methylpent-3-enamide
CID 167136379
3-[[5-[4-(piperidin-4-ylmethyl)piperazin-1-yl]-2-pyridinyl]amino]piperidine-2,6-dione
CID 177300792
N-(2,6-dioxopiperidin-3-yl)-2-formyl-N-methyl-5-[3-(2-oxoethyl)pyrrolidin-1-yl]benzamide
CID 174298906
N,N-dimethyl-5-piperazin-1-ylpyridin-2-amine
CID 152925430

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-(5-piperazin-1-yl-2-pyridinyl)acetamide?
The IUPAC name of N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-(5-piperazin-1-yl-2-pyridinyl)acetamide (CID 155713621) is N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-(5-piperazin-1-yl-2-pyridinyl)acetamide.
What is the SMILES notation for N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-(5-piperazin-1-yl-2-pyridinyl)acetamide?
The canonical SMILES for N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-(5-piperazin-1-yl-2-pyridinyl)acetamide is CN(C(=O)Cc1ccc(N2CCNCC2)cn1)C1CCC(=O)NC1=O.
What is the InChIKey of N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-(5-piperazin-1-yl-2-pyridinyl)acetamide?
The InChIKey is JBSRDECMXYMGFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5O3/c1-21(14-4-5-15(23)20-17(14)25)16(24)10-12-2-3-13(11-19-12)22-8-6-18-7-9-22/h2-3,11,14,18H,4-10H2,1H3,(H,20,23,25).
What are the key properties of N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-(5-piperazin-1-yl-2-pyridinyl)acetamide?
N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-(5-piperazin-1-yl-2-pyridinyl)acetamide has a molecular weight of 345.40 g/mol, XLogP of -0.70, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dioxopiperidin-3-yl)-N-methyl-2-(5-piperazin-1-yl-2-pyridinyl)acetamide is sourced from PubChem (CID 155713621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).