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

C9H14N4O2 — CID 104893299

IUPAC2-amino-N-(6-oxo-1H-pyridazin-3-yl)pentanamide
SMILESCCCC(N)C(=O)Nc1ccc(=O)[nH]n1
InChIInChI=1S/C9H14N4O2/c1-2-3-6(10)9(15)11-7-4-5-8(14)13-12-7/h4-6H,2-3,10H2,1H3,(H,13,14)(H,11,12,15)
InChIKeyVCYGFAZZGIQFKV-UHFFFAOYSA-N
MW210.24 g/mol
LogP-0.16
Rot. Bonds4

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

2-amino-N-(6-oxo-1H-pyridazin-3-yl)pentanamide (PubChem CID 104893299) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is 2-amino-N-(6-oxo-1H-pyridazin-3-yl)pentanamide.

Molecular Properties

Compound Name2-amino-N-(6-oxo-1H-pyridazin-3-yl)pentanamide
PubChem CID104893299
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC Name2-amino-N-(6-oxo-1H-pyridazin-3-yl)pentanamide
SMILESCCCC(N)C(=O)Nc1ccc(=O)[nH]n1
InChIInChI=1S/C9H14N4O2/c1-2-3-6(10)9(15)11-7-4-5-8(14)13-12-7/h4-6H,2-3,10H2,1H3,(H,13,14)(H,11,12,15)
InChIKeyVCYGFAZZGIQFKV-UHFFFAOYSA-N
XLogP-0.16
TPSA100.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 5-0.16
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(6-oxo-1H-pyridazin-3-yl)pentanamide?
The IUPAC name of 2-amino-N-(6-oxo-1H-pyridazin-3-yl)pentanamide (CID 104893299) is 2-amino-N-(6-oxo-1H-pyridazin-3-yl)pentanamide.
What is the SMILES notation for 2-amino-N-(6-oxo-1H-pyridazin-3-yl)pentanamide?
The canonical SMILES for 2-amino-N-(6-oxo-1H-pyridazin-3-yl)pentanamide is CCCC(N)C(=O)Nc1ccc(=O)[nH]n1.
What is the InChIKey of 2-amino-N-(6-oxo-1H-pyridazin-3-yl)pentanamide?
The InChIKey is VCYGFAZZGIQFKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c1-2-3-6(10)9(15)11-7-4-5-8(14)13-12-7/h4-6H,2-3,10H2,1H3,(H,13,14)(H,11,12,15).
What are the key properties of 2-amino-N-(6-oxo-1H-pyridazin-3-yl)pentanamide?
2-amino-N-(6-oxo-1H-pyridazin-3-yl)pentanamide has a molecular weight of 210.24 g/mol, XLogP of -0.16, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(6-oxo-1H-pyridazin-3-yl)pentanamide is sourced from PubChem (CID 104893299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).