2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(2-methylpropyl)acetamide

C15H20N4O3 — CID 16676631

IUPAC2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(2-methylpropyl)acetamide
SMILESCc1ccc(-c2cc(N)c(=O)n(CC(=O)NCC(C)C)n2)o1
InChIInChI=1S/C15H20N4O3/c1-9(2)7-17-14(20)8-19-15(21)11(16)6-12(18-19)13-5-4-10(3)22-13/h4-6,9H,7-8,16H2,1-3H3,(H,17,20)
InChIKeyOBABDQAFXBEOMT-UHFFFAOYSA-N
MW304.35 g/mol
LogP1.17
Rot. Bonds5

About 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(2-methylpropyl)acetamide

2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(2-methylpropyl)acetamide (PubChem CID 16676631) has the molecular formula C15H20N4O3 and a molecular weight of 304.35 g/mol. Its IUPAC name is 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(2-methylpropyl)acetamide
PubChem CID16676631
Molecular FormulaC15H20N4O3
Molecular Weight304.35 g/mol
Exact Mass304.15
IUPAC Name2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(2-methylpropyl)acetamide
SMILESCc1ccc(-c2cc(N)c(=O)n(CC(=O)NCC(C)C)n2)o1
InChIInChI=1S/C15H20N4O3/c1-9(2)7-17-14(20)8-19-15(21)11(16)6-12(18-19)13-5-4-10(3)22-13/h4-6,9H,7-8,16H2,1-3H3,(H,17,20)
InChIKeyOBABDQAFXBEOMT-UHFFFAOYSA-N
XLogP1.17
TPSA103.15 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(2R)-2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(cyclohexylmethyl)propanamide
CID 51496401
2-[5-amino-3-(2,5-dimethylfuran-3-yl)-6-oxopyridazin-1-yl]-N-(2-phenylethyl)acetamide
CID 16676871
1-(3,4-dichlorophenyl)-3-(5-methylfuran-2-yl)-N-(2-methylpropyl)pyrazole-5-carboxamide
CID 3321117
(2S)-2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-cyclohexyl-N-methylpropanamide
CID 51496418
2-[5-amino-3-(5-methylthiophen-2-yl)-6-oxopyridazin-1-yl]-N-(2-phenoxyethyl)acetamide
CID 46961356
2-[5-amino-3-(5-methylthiophen-2-yl)-6-oxopyridazin-1-yl]acetamide
CID 51586148
2-(3-amino-2-oxo-1-pyridinyl)-N-(2-methylpropyl)acetamide
CID 62101797
2-[5-amino-3-(2,5-dimethylfuran-3-yl)-6-oxopyridazin-1-yl]-N-[2-(difluoromethoxy)phenyl]acetamide
CID 16676655
2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide
CID 51589118
2-(5-methylfuran-2-yl)-N-(2-methylpropyl)quinoline-4-carboxamide
CID 3421567
2-(3-amino-4,6-dimethyl-2-oxo-1-pyridinyl)-N-(2-methylpropyl)acetamide
CID 97181469
N-(2-methylpropyl)-2-(1-oxophthalazin-2-yl)acetamide
CID 9369051

Frequently Asked Questions

What is the IUPAC name of 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(2-methylpropyl)acetamide?
The IUPAC name of 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(2-methylpropyl)acetamide (CID 16676631) is 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(2-methylpropyl)acetamide.
What is the SMILES notation for 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(2-methylpropyl)acetamide?
The canonical SMILES for 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(2-methylpropyl)acetamide is Cc1ccc(-c2cc(N)c(=O)n(CC(=O)NCC(C)C)n2)o1.
What is the InChIKey of 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(2-methylpropyl)acetamide?
The InChIKey is OBABDQAFXBEOMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O3/c1-9(2)7-17-14(20)8-19-15(21)11(16)6-12(18-19)13-5-4-10(3)22-13/h4-6,9H,7-8,16H2,1-3H3,(H,17,20).
What are the key properties of 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(2-methylpropyl)acetamide?
2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(2-methylpropyl)acetamide has a molecular weight of 304.35 g/mol, XLogP of 1.17, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 16676631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).