2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N,N-bis(prop-2-enyl)acetamide

C14H20N4O2 — CID 56917737

IUPAC2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N,N-bis(prop-2-enyl)acetamide
SMILESC=CCN(CC=C)C(=O)Cn1ncc(N(C)C)cc1=O
InChIInChI=1S/C14H20N4O2/c1-5-7-17(8-6-2)14(20)11-18-13(19)9-12(10-15-18)16(3)4/h5-6,9-10H,1-2,7-8,11H2,3-4H3
InChIKeyKDMHVVAZVZNTTD-UHFFFAOYSA-N
MW276.34 g/mol
LogP0.51
Rot. Bonds7

About 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N,N-bis(prop-2-enyl)acetamide

2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N,N-bis(prop-2-enyl)acetamide (PubChem CID 56917737) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N,N-bis(prop-2-enyl)acetamide.

Molecular Properties

Compound Name2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N,N-bis(prop-2-enyl)acetamide
PubChem CID56917737
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N,N-bis(prop-2-enyl)acetamide
SMILESC=CCN(CC=C)C(=O)Cn1ncc(N(C)C)cc1=O
InChIInChI=1S/C14H20N4O2/c1-5-7-17(8-6-2)14(20)11-18-13(19)9-12(10-15-18)16(3)4/h5-6,9-10H,1-2,7-8,11H2,3-4H3
InChIKeyKDMHVVAZVZNTTD-UHFFFAOYSA-N
XLogP0.51
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 50.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N,N-bis(prop-2-enyl)acetamide?
The IUPAC name of 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N,N-bis(prop-2-enyl)acetamide (CID 56917737) is 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N,N-bis(prop-2-enyl)acetamide.
What is the SMILES notation for 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N,N-bis(prop-2-enyl)acetamide?
The canonical SMILES for 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N,N-bis(prop-2-enyl)acetamide is C=CCN(CC=C)C(=O)Cn1ncc(N(C)C)cc1=O.
What is the InChIKey of 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N,N-bis(prop-2-enyl)acetamide?
The InChIKey is KDMHVVAZVZNTTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-5-7-17(8-6-2)14(20)11-18-13(19)9-12(10-15-18)16(3)4/h5-6,9-10H,1-2,7-8,11H2,3-4H3.
What are the key properties of 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N,N-bis(prop-2-enyl)acetamide?
2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N,N-bis(prop-2-enyl)acetamide has a molecular weight of 276.34 g/mol, XLogP of 0.51, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N,N-bis(prop-2-enyl)acetamide is sourced from PubChem (CID 56917737), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).