3-(6-aminopyridazin-3-yl)-2,3-dihydroxypropanamide

C7H10N4O3 — CID 171867681

IUPAC3-(6-aminopyridazin-3-yl)-2,3-dihydroxypropanamide
SMILESNC(=O)C(O)C(O)c1ccc(N)nn1
InChIInChI=1S/C7H10N4O3/c8-4-2-1-3(10-11-4)5(12)6(13)7(9)14/h1-2,5-6,12-13H,(H2,8,11)(H2,9,14)
InChIKeyIPEDYFQUUTYARA-UHFFFAOYSA-N
MW198.18 g/mol
LogP-2.06
Rot. Bonds3

About 3-(6-aminopyridazin-3-yl)-2,3-dihydroxypropanamide

3-(6-aminopyridazin-3-yl)-2,3-dihydroxypropanamide (PubChem CID 171867681) has the molecular formula C7H10N4O3 and a molecular weight of 198.18 g/mol. Its IUPAC name is 3-(6-aminopyridazin-3-yl)-2,3-dihydroxypropanamide.

Molecular Properties

Compound Name3-(6-aminopyridazin-3-yl)-2,3-dihydroxypropanamide
PubChem CID171867681
Molecular FormulaC7H10N4O3
Molecular Weight198.18 g/mol
Exact Mass198.08
IUPAC Name3-(6-aminopyridazin-3-yl)-2,3-dihydroxypropanamide
SMILESNC(=O)C(O)C(O)c1ccc(N)nn1
InChIInChI=1S/C7H10N4O3/c8-4-2-1-3(10-11-4)5(12)6(13)7(9)14/h1-2,5-6,12-13H,(H2,8,11)(H2,9,14)
InChIKeyIPEDYFQUUTYARA-UHFFFAOYSA-N
XLogP-2.06
TPSA135.35 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.18
LogP ≤ 5-2.06
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(6-aminopyridazin-3-yl)-2,3-dihydroxypropanamide?
The IUPAC name of 3-(6-aminopyridazin-3-yl)-2,3-dihydroxypropanamide (CID 171867681) is 3-(6-aminopyridazin-3-yl)-2,3-dihydroxypropanamide.
What is the SMILES notation for 3-(6-aminopyridazin-3-yl)-2,3-dihydroxypropanamide?
The canonical SMILES for 3-(6-aminopyridazin-3-yl)-2,3-dihydroxypropanamide is NC(=O)C(O)C(O)c1ccc(N)nn1.
What is the InChIKey of 3-(6-aminopyridazin-3-yl)-2,3-dihydroxypropanamide?
The InChIKey is IPEDYFQUUTYARA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4O3/c8-4-2-1-3(10-11-4)5(12)6(13)7(9)14/h1-2,5-6,12-13H,(H2,8,11)(H2,9,14).
What are the key properties of 3-(6-aminopyridazin-3-yl)-2,3-dihydroxypropanamide?
3-(6-aminopyridazin-3-yl)-2,3-dihydroxypropanamide has a molecular weight of 198.18 g/mol, XLogP of -2.06, 3 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-aminopyridazin-3-yl)-2,3-dihydroxypropanamide is sourced from PubChem (CID 171867681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).