(2R)-2-amino-N-(6-oxo-1H-pyridazin-3-yl)propanamide

C7H10N4O2 — CID 104893306

IUPAC(2R)-2-amino-N-(6-oxo-1H-pyridazin-3-yl)propanamide
SMILESC[C@@H](N)C(=O)Nc1ccc(=O)[nH]n1
InChIInChI=1S/C7H10N4O2/c1-4(8)7(13)9-5-2-3-6(12)11-10-5/h2-4H,8H2,1H3,(H,11,12)(H,9,10,13)/t4-/m1/s1
InChIKeyQQMARSZQCGEPHS-SCSAIBSYSA-N
MW182.18 g/mol
LogP-0.94
Rot. Bonds2

About (2R)-2-amino-N-(6-oxo-1H-pyridazin-3-yl)propanamide

(2R)-2-amino-N-(6-oxo-1H-pyridazin-3-yl)propanamide (PubChem CID 104893306) has the molecular formula C7H10N4O2 and a molecular weight of 182.18 g/mol. Its IUPAC name is (2R)-2-amino-N-(6-oxo-1H-pyridazin-3-yl)propanamide.

Molecular Properties

Compound Name(2R)-2-amino-N-(6-oxo-1H-pyridazin-3-yl)propanamide
PubChem CID104893306
Molecular FormulaC7H10N4O2
Molecular Weight182.18 g/mol
Exact Mass182.08
IUPAC Name(2R)-2-amino-N-(6-oxo-1H-pyridazin-3-yl)propanamide
SMILESC[C@@H](N)C(=O)Nc1ccc(=O)[nH]n1
InChIInChI=1S/C7H10N4O2/c1-4(8)7(13)9-5-2-3-6(12)11-10-5/h2-4H,8H2,1H3,(H,11,12)(H,9,10,13)/t4-/m1/s1
InChIKeyQQMARSZQCGEPHS-SCSAIBSYSA-N
XLogP-0.94
TPSA100.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.18
LogP ≤ 5-0.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-N-(6-oxo-1H-pyridazin-3-yl)propanamide?
The IUPAC name of (2R)-2-amino-N-(6-oxo-1H-pyridazin-3-yl)propanamide (CID 104893306) is (2R)-2-amino-N-(6-oxo-1H-pyridazin-3-yl)propanamide.
What is the SMILES notation for (2R)-2-amino-N-(6-oxo-1H-pyridazin-3-yl)propanamide?
The canonical SMILES for (2R)-2-amino-N-(6-oxo-1H-pyridazin-3-yl)propanamide is C[C@@H](N)C(=O)Nc1ccc(=O)[nH]n1.
What is the InChIKey of (2R)-2-amino-N-(6-oxo-1H-pyridazin-3-yl)propanamide?
The InChIKey is QQMARSZQCGEPHS-SCSAIBSYSA-N. The full InChI is InChI=1S/C7H10N4O2/c1-4(8)7(13)9-5-2-3-6(12)11-10-5/h2-4H,8H2,1H3,(H,11,12)(H,9,10,13)/t4-/m1/s1.
What are the key properties of (2R)-2-amino-N-(6-oxo-1H-pyridazin-3-yl)propanamide?
(2R)-2-amino-N-(6-oxo-1H-pyridazin-3-yl)propanamide has a molecular weight of 182.18 g/mol, XLogP of -0.94, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-N-(6-oxo-1H-pyridazin-3-yl)propanamide is sourced from PubChem (CID 104893306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).