2-[4-(cyclobutylamino)-6-oxopyridazin-1-yl]-N-cyclopropyl-N-methylacetamide

C14H20N4O2 — CID 103220607

IUPAC2-[4-(cyclobutylamino)-6-oxopyridazin-1-yl]-N-cyclopropyl-N-methylacetamide
SMILESCN(C(=O)Cn1ncc(NC2CCC2)cc1=O)C1CC1
InChIInChI=1S/C14H20N4O2/c1-17(12-5-6-12)14(20)9-18-13(19)7-11(8-15-18)16-10-3-2-4-10/h7-8,10,12,16H,2-6,9H2,1H3
InChIKeyCFULPAUPAKKXQW-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.83
Rot. Bonds5

About 2-[4-(cyclobutylamino)-6-oxopyridazin-1-yl]-N-cyclopropyl-N-methylacetamide

2-[4-(cyclobutylamino)-6-oxopyridazin-1-yl]-N-cyclopropyl-N-methylacetamide (PubChem CID 103220607) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 2-[4-(cyclobutylamino)-6-oxopyridazin-1-yl]-N-cyclopropyl-N-methylacetamide.

Molecular Properties

Compound Name2-[4-(cyclobutylamino)-6-oxopyridazin-1-yl]-N-cyclopropyl-N-methylacetamide
PubChem CID103220607
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name2-[4-(cyclobutylamino)-6-oxopyridazin-1-yl]-N-cyclopropyl-N-methylacetamide
SMILESCN(C(=O)Cn1ncc(NC2CCC2)cc1=O)C1CC1
InChIInChI=1S/C14H20N4O2/c1-17(12-5-6-12)14(20)9-18-13(19)7-11(8-15-18)16-10-3-2-4-10/h7-8,10,12,16H,2-6,9H2,1H3
InChIKeyCFULPAUPAKKXQW-UHFFFAOYSA-N
XLogP0.83
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(cyclobutylamino)-6-oxopyridazin-1-yl]-N-cyclopropyl-N-methylacetamide?
The IUPAC name of 2-[4-(cyclobutylamino)-6-oxopyridazin-1-yl]-N-cyclopropyl-N-methylacetamide (CID 103220607) is 2-[4-(cyclobutylamino)-6-oxopyridazin-1-yl]-N-cyclopropyl-N-methylacetamide.
What is the SMILES notation for 2-[4-(cyclobutylamino)-6-oxopyridazin-1-yl]-N-cyclopropyl-N-methylacetamide?
The canonical SMILES for 2-[4-(cyclobutylamino)-6-oxopyridazin-1-yl]-N-cyclopropyl-N-methylacetamide is CN(C(=O)Cn1ncc(NC2CCC2)cc1=O)C1CC1.
What is the InChIKey of 2-[4-(cyclobutylamino)-6-oxopyridazin-1-yl]-N-cyclopropyl-N-methylacetamide?
The InChIKey is CFULPAUPAKKXQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-17(12-5-6-12)14(20)9-18-13(19)7-11(8-15-18)16-10-3-2-4-10/h7-8,10,12,16H,2-6,9H2,1H3.
What are the key properties of 2-[4-(cyclobutylamino)-6-oxopyridazin-1-yl]-N-cyclopropyl-N-methylacetamide?
2-[4-(cyclobutylamino)-6-oxopyridazin-1-yl]-N-cyclopropyl-N-methylacetamide has a molecular weight of 276.34 g/mol, XLogP of 0.83, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(cyclobutylamino)-6-oxopyridazin-1-yl]-N-cyclopropyl-N-methylacetamide is sourced from PubChem (CID 103220607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).