2-amino-N-(6-oxo-1H-pyridazin-3-yl)-6-propylpyridine-4-carboxamide

C13H15N5O2 — CID 116788000

IUPAC2-amino-N-(6-oxo-1H-pyridazin-3-yl)-6-propylpyridine-4-carboxamide
SMILESCCCc1cc(C(=O)Nc2ccc(=O)[nH]n2)cc(N)n1
InChIInChI=1S/C13H15N5O2/c1-2-3-9-6-8(7-10(14)15-9)13(20)16-11-4-5-12(19)18-17-11/h4-7H,2-3H2,1H3,(H2,14,15)(H,18,19)(H,16,17,20)
InChIKeyKJAVSYMZSFPTOP-UHFFFAOYSA-N
MW273.30 g/mol
LogP0.95
Rot. Bonds4

About 2-amino-N-(6-oxo-1H-pyridazin-3-yl)-6-propylpyridine-4-carboxamide

2-amino-N-(6-oxo-1H-pyridazin-3-yl)-6-propylpyridine-4-carboxamide (PubChem CID 116788000) has the molecular formula C13H15N5O2 and a molecular weight of 273.30 g/mol. Its IUPAC name is 2-amino-N-(6-oxo-1H-pyridazin-3-yl)-6-propylpyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(6-oxo-1H-pyridazin-3-yl)-6-propylpyridine-4-carboxamide
PubChem CID116788000
Molecular FormulaC13H15N5O2
Molecular Weight273.30 g/mol
Exact Mass273.12
IUPAC Name2-amino-N-(6-oxo-1H-pyridazin-3-yl)-6-propylpyridine-4-carboxamide
SMILESCCCc1cc(C(=O)Nc2ccc(=O)[nH]n2)cc(N)n1
InChIInChI=1S/C13H15N5O2/c1-2-3-9-6-8(7-10(14)15-9)13(20)16-11-4-5-12(19)18-17-11/h4-7H,2-3H2,1H3,(H2,14,15)(H,18,19)(H,16,17,20)
InChIKeyKJAVSYMZSFPTOP-UHFFFAOYSA-N
XLogP0.95
TPSA113.76 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.30
LogP ≤ 50.95
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-6-ethyl-N-(6-oxo-1H-pyridazin-3-yl)pyridine-4-carboxamide
CID 116786621
4-amino-3,5-dichloro-N-(6-oxo-1H-pyridazin-3-yl)benzamide
CID 116786983
2-amino-N-(cyclopropylmethyl)-6-propylpyridine-4-carboxamide
CID 113380957
2-amino-N-(3-bromo-2-methylphenyl)-6-propylpyridine-4-carboxamide
CID 107631129
2-amino-N-(3-methylpentan-3-yl)-6-propylpyridine-4-carboxamide
CID 106331239
2-amino-N-[(2-oxo-3H-1,3-thiazol-4-yl)methyl]-6-propylpyridine-4-carboxamide
CID 106383344
4-fluoro-N-(6-oxo-1H-pyridazin-3-yl)benzamide
CID 116786641
2-amino-6-propyl-N-(2,2,3,3-tetrafluoropropyl)pyridine-4-carboxamide
CID 106295513
2-oxo-N-(5-propyl-1H-pyrazol-3-yl)-1H-pyridine-4-carboxamide
CID 113257565
6-bromo-N-(6-oxo-1H-pyridazin-3-yl)naphthalene-2-carboxamide
CID 116787217
5-(ethylamino)-N-(6-oxo-1H-pyridazin-3-yl)pyrazine-2-carboxamide
CID 107377055
N-(6-oxo-1H-pyridazin-3-yl)-1H-indazole-6-carboxamide
CID 116787487

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(6-oxo-1H-pyridazin-3-yl)-6-propylpyridine-4-carboxamide?
The IUPAC name of 2-amino-N-(6-oxo-1H-pyridazin-3-yl)-6-propylpyridine-4-carboxamide (CID 116788000) is 2-amino-N-(6-oxo-1H-pyridazin-3-yl)-6-propylpyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-(6-oxo-1H-pyridazin-3-yl)-6-propylpyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-(6-oxo-1H-pyridazin-3-yl)-6-propylpyridine-4-carboxamide is CCCc1cc(C(=O)Nc2ccc(=O)[nH]n2)cc(N)n1.
What is the InChIKey of 2-amino-N-(6-oxo-1H-pyridazin-3-yl)-6-propylpyridine-4-carboxamide?
The InChIKey is KJAVSYMZSFPTOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N5O2/c1-2-3-9-6-8(7-10(14)15-9)13(20)16-11-4-5-12(19)18-17-11/h4-7H,2-3H2,1H3,(H2,14,15)(H,18,19)(H,16,17,20).
What are the key properties of 2-amino-N-(6-oxo-1H-pyridazin-3-yl)-6-propylpyridine-4-carboxamide?
2-amino-N-(6-oxo-1H-pyridazin-3-yl)-6-propylpyridine-4-carboxamide has a molecular weight of 273.30 g/mol, XLogP of 0.95, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(6-oxo-1H-pyridazin-3-yl)-6-propylpyridine-4-carboxamide is sourced from PubChem (CID 116788000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).