N-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide

C16H23N5O3 — CID 70733059

IUPACN-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESCn1ncc(N2CCC(CNC(=O)CN3CCCC3=O)C2)cc1=O
InChIInChI=1S/C16H23N5O3/c1-19-16(24)7-13(9-18-19)20-6-4-12(10-20)8-17-14(22)11-21-5-2-3-15(21)23/h7,9,12H,2-6,8,10-11H2,1H3,(H,17,22)
InChIKeyMNWVWOGXLLFOIZ-UHFFFAOYSA-N
MW333.39 g/mol
LogP-0.65
Rot. Bonds5

About N-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide

N-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide (PubChem CID 70733059) has the molecular formula C16H23N5O3 and a molecular weight of 333.39 g/mol. Its IUPAC name is N-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide
PubChem CID70733059
Molecular FormulaC16H23N5O3
Molecular Weight333.39 g/mol
Exact Mass333.18
IUPAC NameN-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESCn1ncc(N2CCC(CNC(=O)CN3CCCC3=O)C2)cc1=O
InChIInChI=1S/C16H23N5O3/c1-19-16(24)7-13(9-18-19)20-6-4-12(10-20)8-17-14(22)11-21-5-2-3-15(21)23/h7,9,12H,2-6,8,10-11H2,1H3,(H,17,22)
InChIKeyMNWVWOGXLLFOIZ-UHFFFAOYSA-N
XLogP-0.65
TPSA87.54 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.39
LogP ≤ 5-0.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The IUPAC name of N-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide (CID 70733059) is N-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide.
What is the SMILES notation for N-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The canonical SMILES for N-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide is Cn1ncc(N2CCC(CNC(=O)CN3CCCC3=O)C2)cc1=O.
What is the InChIKey of N-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
The InChIKey is MNWVWOGXLLFOIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O3/c1-19-16(24)7-13(9-18-19)20-6-4-12(10-20)8-17-14(22)11-21-5-2-3-15(21)23/h7,9,12H,2-6,8,10-11H2,1H3,(H,17,22).
What are the key properties of N-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide?
N-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide has a molecular weight of 333.39 g/mol, XLogP of -0.65, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(1-methyl-6-oxopyridazin-4-yl)pyrrolidin-3-yl]methyl]-2-(2-oxopyrrolidin-1-yl)acetamide is sourced from PubChem (CID 70733059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).