N-cyclopropyl-N-methyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide

C13H20N4O2 — CID 103219498

IUPACN-cyclopropyl-N-methyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide
SMILESCC(C)Nc1cnn(CC(=O)N(C)C2CC2)c(=O)c1
InChIInChI=1S/C13H20N4O2/c1-9(2)15-10-6-12(18)17(14-7-10)8-13(19)16(3)11-4-5-11/h6-7,9,11,15H,4-5,8H2,1-3H3
InChIKeyPXLNVZVFLBZYHI-UHFFFAOYSA-N
MW264.33 g/mol
LogP0.68
Rot. Bonds5

About N-cyclopropyl-N-methyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide

N-cyclopropyl-N-methyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide (PubChem CID 103219498) has the molecular formula C13H20N4O2 and a molecular weight of 264.33 g/mol. Its IUPAC name is N-cyclopropyl-N-methyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-methyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide
PubChem CID103219498
Molecular FormulaC13H20N4O2
Molecular Weight264.33 g/mol
Exact Mass264.16
IUPAC NameN-cyclopropyl-N-methyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide
SMILESCC(C)Nc1cnn(CC(=O)N(C)C2CC2)c(=O)c1
InChIInChI=1S/C13H20N4O2/c1-9(2)15-10-6-12(18)17(14-7-10)8-13(19)16(3)11-4-5-11/h6-7,9,11,15H,4-5,8H2,1-3H3
InChIKeyPXLNVZVFLBZYHI-UHFFFAOYSA-N
XLogP0.68
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-methyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide?
The IUPAC name of N-cyclopropyl-N-methyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide (CID 103219498) is N-cyclopropyl-N-methyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide.
What is the SMILES notation for N-cyclopropyl-N-methyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide?
The canonical SMILES for N-cyclopropyl-N-methyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide is CC(C)Nc1cnn(CC(=O)N(C)C2CC2)c(=O)c1.
What is the InChIKey of N-cyclopropyl-N-methyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide?
The InChIKey is PXLNVZVFLBZYHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O2/c1-9(2)15-10-6-12(18)17(14-7-10)8-13(19)16(3)11-4-5-11/h6-7,9,11,15H,4-5,8H2,1-3H3.
What are the key properties of N-cyclopropyl-N-methyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide?
N-cyclopropyl-N-methyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide has a molecular weight of 264.33 g/mol, XLogP of 0.68, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-methyl-2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]acetamide is sourced from PubChem (CID 103219498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).