2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N,N-di(propan-2-yl)propanamide

C17H24N4O3 — CID 46961338

IUPAC2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N,N-di(propan-2-yl)propanamide
SMILESCC(C)N(C(=O)C(C)n1nc(-c2ccco2)cc(N)c1=O)C(C)C
InChIInChI=1S/C17H24N4O3/c1-10(2)20(11(3)4)16(22)12(5)21-17(23)13(18)9-14(19-21)15-7-6-8-24-15/h6-12H,18H2,1-5H3
InChIKeyRMQWCHSRTLIJHI-UHFFFAOYSA-N
MW332.40 g/mol
LogP2.29
Rot. Bonds5

About 2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N,N-di(propan-2-yl)propanamide

2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N,N-di(propan-2-yl)propanamide (PubChem CID 46961338) has the molecular formula C17H24N4O3 and a molecular weight of 332.40 g/mol. Its IUPAC name is 2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N,N-di(propan-2-yl)propanamide.

Molecular Properties

Compound Name2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N,N-di(propan-2-yl)propanamide
PubChem CID46961338
Molecular FormulaC17H24N4O3
Molecular Weight332.40 g/mol
Exact Mass332.18
IUPAC Name2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N,N-di(propan-2-yl)propanamide
SMILESCC(C)N(C(=O)C(C)n1nc(-c2ccco2)cc(N)c1=O)C(C)C
InChIInChI=1S/C17H24N4O3/c1-10(2)20(11(3)4)16(22)12(5)21-17(23)13(18)9-14(19-21)15-7-6-8-24-15/h6-12H,18H2,1-5H3
InChIKeyRMQWCHSRTLIJHI-UHFFFAOYSA-N
XLogP2.29
TPSA94.36 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(2R)-2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N,N-bis(prop-2-enyl)propanamide
CID 51496315
4-amino-2-[(2R)-1-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-1-oxopropan-2-yl]-6-(furan-2-yl)pyridazin-3-one
CID 51496299
(2R)-2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-(3-methoxypropyl)propanamide
CID 51583817
(2S)-2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-(5,6,7,8-tetrahydronaphthalen-1-yl)propanamide
CID 51496285
2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]acetamide
CID 51589118
(2S)-2-[5-amino-3-(5-methylfuran-2-yl)-6-oxopyridazin-1-yl]-N-cyclohexyl-N-methylpropanamide
CID 51496418
1-(1-cyclopropylethyl)-3-(furan-2-yl)pyrazol-5-amine
CID 61271706
4-amino-2-[2-[(2S,6S)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl]-6-(furan-2-yl)pyridazin-3-one
CID 51495017
N-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-methylpropanamide
CID 121076093
(4aS,8aR)-4-[2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]acetyl]-3,3-dimethyl-4a,5,6,7,8,8a-hexahydro-1H-quinoxalin-2-one
CID 51592580
2-[5-amino-3-(5-methylthiophen-2-yl)-6-oxopyridazin-1-yl]propanamide
CID 46961366
N-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-(2-phenylethyl)propanamide
CID 121076114

Frequently Asked Questions

What is the IUPAC name of 2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N,N-di(propan-2-yl)propanamide?
The IUPAC name of 2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N,N-di(propan-2-yl)propanamide (CID 46961338) is 2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N,N-di(propan-2-yl)propanamide.
What is the SMILES notation for 2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N,N-di(propan-2-yl)propanamide?
The canonical SMILES for 2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N,N-di(propan-2-yl)propanamide is CC(C)N(C(=O)C(C)n1nc(-c2ccco2)cc(N)c1=O)C(C)C.
What is the InChIKey of 2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N,N-di(propan-2-yl)propanamide?
The InChIKey is RMQWCHSRTLIJHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N4O3/c1-10(2)20(11(3)4)16(22)12(5)21-17(23)13(18)9-14(19-21)15-7-6-8-24-15/h6-12H,18H2,1-5H3.
What are the key properties of 2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N,N-di(propan-2-yl)propanamide?
2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N,N-di(propan-2-yl)propanamide has a molecular weight of 332.40 g/mol, XLogP of 2.29, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-amino-3-(furan-2-yl)-6-oxopyridazin-1-yl]-N,N-di(propan-2-yl)propanamide is sourced from PubChem (CID 46961338), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).