2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propan-2-ylpropanamide

C15H20N4O3 — CID 46961636

IUPAC2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propan-2-ylpropanamide
SMILESCc1ccc(-c2cc(N)c(=O)n(C(C)C(=O)NC(C)C)n2)o1
InChIInChI=1S/C15H20N4O3/c1-8(2)17-14(20)10(4)19-15(21)11(16)7-12(18-19)13-6-5-9(3)22-13/h5-8,10H,16H2,1-4H3,(H,17,20)
InChIKeyRAIXGHBTUFFCJN-UHFFFAOYSA-N
MW304.35 g/mol
LogP1.48
Rot. Bonds4

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

2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propan-2-ylpropanamide (PubChem CID 46961636) 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-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propan-2-ylpropanamide
PubChem CID46961636
Molecular FormulaC15H20N4O3
Molecular Weight304.35 g/mol
Exact Mass304.15
IUPAC Name2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propan-2-ylpropanamide
SMILESCc1ccc(-c2cc(N)c(=O)n(C(C)C(=O)NC(C)C)n2)o1
InChIInChI=1S/C15H20N4O3/c1-8(2)17-14(20)10(4)19-15(21)11(16)7-12(18-19)13-6-5-9(3)22-13/h5-8,10H,16H2,1-4H3,(H,17,20)
InChIKeyRAIXGHBTUFFCJN-UHFFFAOYSA-N
XLogP1.48
TPSA103.15 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

(E)-N-[2-[(2Z)-2-[1-(furan-2-yl)ethylidene]hydrazinyl]-2-oxoethyl]-3-phenylprop-2-enamide
CID 6371505
2-[5-amino-3-(2,5-dimethylfuran-3-yl)-6-oxopyridazin-1-yl]-N-cyclohexylacetamide
CID 16676518
4-Amino-2-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]-6-(5-methylfuran-2-yl)pyridazin-3-one
CID 16676621
2-[5-amino-3-(2,5-dimethylfuran-3-yl)-6-oxopyridazin-1-yl]-N-(cyclohexylmethyl)acetamide
CID 16676651
2,2,2-trifluoro-N-(2-(3-(furan-2-yl)-6-oxopyridazin-1(6H)-yl)ethyl)acetamide
CID 16905497
2-[5-amino-3-(2,5-dimethylfuran-3-yl)-6-oxopyridazin-1-yl]-N-cyclopentylacetamide
CID 46961152
2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-(2-methoxyethyl)propanamide
CID 46961343
2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-(3-methoxypropyl)propanamide
CID 46961350
2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-(2-methoxyethyl)propanamide
CID 46961632
2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propylpropanamide
CID 46961638
4-Amino-6-(2,5-dimethylfuran-3-yl)-2-[2-(2-ethylpiperidin-1-yl)-2-oxoethyl]pyridazin-3-one
CID 46961833
2-[5-Amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]propanamide
CID 75679857

Frequently Asked Questions

What is the IUPAC name of 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propan-2-ylpropanamide?
The IUPAC name of 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propan-2-ylpropanamide (CID 46961636) is 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propan-2-ylpropanamide?
The canonical SMILES for 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propan-2-ylpropanamide is Cc1ccc(-c2cc(N)c(=O)n(C(C)C(=O)NC(C)C)n2)o1.
What is the InChIKey of 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propan-2-ylpropanamide?
The InChIKey is RAIXGHBTUFFCJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O3/c1-8(2)17-14(20)10(4)19-15(21)11(16)7-12(18-19)13-6-5-9(3)22-13/h5-8,10H,16H2,1-4H3,(H,17,20).
What are the key properties of 2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propan-2-ylpropanamide?
2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-propan-2-ylpropanamide has a molecular weight of 304.35 g/mol, XLogP of 1.48, 4 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-propan-2-ylpropanamide is sourced from PubChem (CID 46961636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).