N-(furan-2-ylmethyl)-6-oxo-1H-pyridazine-3-carboxamide

C10H9N3O3 — CID 660122

IUPACN-(furan-2-ylmethyl)-6-oxo-1H-pyridazine-3-carboxamide
SMILESO=C(NCc1ccco1)c1ccc(=O)[nH]n1
InChIInChI=1S/C10H9N3O3/c14-9-4-3-8(12-13-9)10(15)11-6-7-2-1-5-16-7/h1-5H,6H2,(H,11,15)(H,13,14)
InChIKeyGSUYAQDZNGDSOZ-UHFFFAOYSA-N
MW219.20 g/mol
LogP0.29
Rot. Bonds3

About N-(furan-2-ylmethyl)-6-oxo-1H-pyridazine-3-carboxamide

N-(furan-2-ylmethyl)-6-oxo-1H-pyridazine-3-carboxamide (PubChem CID 660122) has the molecular formula C10H9N3O3 and a molecular weight of 219.20 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-6-oxo-1H-pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-6-oxo-1H-pyridazine-3-carboxamide
PubChem CID660122
Molecular FormulaC10H9N3O3
Molecular Weight219.20 g/mol
Exact Mass219.06
IUPAC NameN-(furan-2-ylmethyl)-6-oxo-1H-pyridazine-3-carboxamide
SMILESO=C(NCc1ccco1)c1ccc(=O)[nH]n1
InChIInChI=1S/C10H9N3O3/c14-9-4-3-8(12-13-9)10(15)11-6-7-2-1-5-16-7/h1-5H,6H2,(H,11,15)(H,13,14)
InChIKeyGSUYAQDZNGDSOZ-UHFFFAOYSA-N
XLogP0.29
TPSA87.99 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.20
LogP ≤ 50.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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N-(furan-2-ylmethyl)-2-oxo-2H-pyran-5-carboxamide
CID 660186
N'-(1-methyl-4-piperidinylidene)-2-furohydrazide
CID 868151
Methyl 4-[(2-furylmethyl)amino]-4-oxo-2-butenoate
CID 1820304
N-(furan-2-ylmethyl)-3-[[2-(3-methoxyphenoxy)acetyl]hydrazinylidene]butanamide
CID 3101329
N-Furan-2-ylmethyl-3-[(2-p-tolyloxy-acetyl)-hydrazono]-butyramide
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CID 9821406

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-6-oxo-1H-pyridazine-3-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-6-oxo-1H-pyridazine-3-carboxamide (CID 660122) is N-(furan-2-ylmethyl)-6-oxo-1H-pyridazine-3-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-6-oxo-1H-pyridazine-3-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-6-oxo-1H-pyridazine-3-carboxamide is O=C(NCc1ccco1)c1ccc(=O)[nH]n1.
What is the InChIKey of N-(furan-2-ylmethyl)-6-oxo-1H-pyridazine-3-carboxamide?
The InChIKey is GSUYAQDZNGDSOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O3/c14-9-4-3-8(12-13-9)10(15)11-6-7-2-1-5-16-7/h1-5H,6H2,(H,11,15)(H,13,14).
What are the key properties of N-(furan-2-ylmethyl)-6-oxo-1H-pyridazine-3-carboxamide?
N-(furan-2-ylmethyl)-6-oxo-1H-pyridazine-3-carboxamide has a molecular weight of 219.20 g/mol, XLogP of 0.29, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-6-oxo-1H-pyridazine-3-carboxamide is sourced from PubChem (CID 660122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).