2-amino-3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]propanamide

C10H17N5O2 — CID 114394012

IUPAC2-amino-3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]propanamide
SMILESCCN(C)c1cnn(CC(N)C(N)=O)c(=O)c1
InChIInChI=1S/C10H17N5O2/c1-3-14(2)7-4-9(16)15(13-5-7)6-8(11)10(12)17/h4-5,8H,3,6,11H2,1-2H3,(H2,12,17)
InChIKeyWRSFOFFZPVQQLB-UHFFFAOYSA-N
MW239.28 g/mol
LogP-1.49
Rot. Bonds5

About 2-amino-3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]propanamide

2-amino-3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]propanamide (PubChem CID 114394012) has the molecular formula C10H17N5O2 and a molecular weight of 239.28 g/mol. Its IUPAC name is 2-amino-3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]propanamide.

Molecular Properties

Compound Name2-amino-3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]propanamide
PubChem CID114394012
Molecular FormulaC10H17N5O2
Molecular Weight239.28 g/mol
Exact Mass239.14
IUPAC Name2-amino-3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]propanamide
SMILESCCN(C)c1cnn(CC(N)C(N)=O)c(=O)c1
InChIInChI=1S/C10H17N5O2/c1-3-14(2)7-4-9(16)15(13-5-7)6-8(11)10(12)17/h4-5,8H,3,6,11H2,1-2H3,(H2,12,17)
InChIKeyWRSFOFFZPVQQLB-UHFFFAOYSA-N
XLogP-1.49
TPSA107.24 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 5-1.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]acetamide
CID 114397031
5-[ethyl(methyl)amino]-2-(2-methyl-3-sulfanylpropyl)pyridazin-3-one
CID 114399054
2-(3-amino-2-ethoxypropyl)-5-[ethyl(methyl)amino]pyridazin-3-one
CID 114393747
3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]-2-methylpropanenitrile
CID 114395697
3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]propanethioamide
CID 114395814
5-[ethyl(methyl)amino]-2-(4-hydroxybutyl)pyridazin-3-one
CID 114396533
2-(3-amino-2-phenylpropyl)-5-[ethyl(methyl)amino]pyridazin-3-one
CID 114393745
2-[2-amino-2-(3-methylphenyl)ethyl]-5-[ethyl(methyl)amino]pyridazin-3-one
CID 114394810
5-[ethyl(methyl)amino]-2-(4-oxopentyl)pyridazin-3-one
CID 114396211
ethyl 4-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]-3-oxobutanoate
CID 114396186
2-(4-bromobutyl)-5-[ethyl(methyl)amino]pyridazin-3-one
CID 114394326
2-[2-(ethylamino)-3-methylpentyl]-5-[ethyl(methyl)amino]pyridazin-3-one
CID 114394815

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]propanamide?
The IUPAC name of 2-amino-3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]propanamide (CID 114394012) is 2-amino-3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]propanamide.
What is the SMILES notation for 2-amino-3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]propanamide?
The canonical SMILES for 2-amino-3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]propanamide is CCN(C)c1cnn(CC(N)C(N)=O)c(=O)c1.
What is the InChIKey of 2-amino-3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]propanamide?
The InChIKey is WRSFOFFZPVQQLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5O2/c1-3-14(2)7-4-9(16)15(13-5-7)6-8(11)10(12)17/h4-5,8H,3,6,11H2,1-2H3,(H2,12,17).
What are the key properties of 2-amino-3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]propanamide?
2-amino-3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]propanamide has a molecular weight of 239.28 g/mol, XLogP of -1.49, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-[4-[ethyl(methyl)amino]-6-oxopyridazin-1-yl]propanamide is sourced from PubChem (CID 114394012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).