N-(furan-2-ylmethyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide

C19H20N4O2 — CID 109117595

IUPACN-(furan-2-ylmethyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide
SMILESCC(C)c1ccccc1Nc1ccc(C(=O)NCc2ccco2)nn1
InChIInChI=1S/C19H20N4O2/c1-13(2)15-7-3-4-8-16(15)21-18-10-9-17(22-23-18)19(24)20-12-14-6-5-11-25-14/h3-11,13H,12H2,1-2H3,(H,20,24)(H,21,23)
InChIKeyUZMLKZUJFZHDOJ-UHFFFAOYSA-N
MW336.40 g/mol
LogP3.87
Rot. Bonds6

About N-(furan-2-ylmethyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide

N-(furan-2-ylmethyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide (PubChem CID 109117595) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide
PubChem CID109117595
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC NameN-(furan-2-ylmethyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide
SMILESCC(C)c1ccccc1Nc1ccc(C(=O)NCc2ccco2)nn1
InChIInChI=1S/C19H20N4O2/c1-13(2)15-7-3-4-8-16(15)21-18-10-9-17(22-23-18)19(24)20-12-14-6-5-11-25-14/h3-11,13H,12H2,1-2H3,(H,20,24)(H,21,23)
InChIKeyUZMLKZUJFZHDOJ-UHFFFAOYSA-N
XLogP3.87
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(ethylamino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide
CID 62172875
6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide
CID 109117625
N-(furan-2-ylmethyl)-6-(3-methylanilino)pyridazine-3-carboxamide
CID 109117580
6-(benzylamino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide
CID 109117515
6-(cyclopropylamino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide
CID 109109812
6-amino-N-(furan-2-ylmethyl)pyridazine-3-carboxamide
CID 62156387
N-(5-methyl-1,2-oxazol-3-yl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide
CID 109128180
6-(2-fluoroanilino)-N-(2-propan-2-ylphenyl)pyridazine-3-carboxamide
CID 109128181
N-(furan-2-ylmethyl)-6-(4-piperidin-1-ylanilino)pyridazine-3-carboxamide
CID 109117643
6-hydrazinyl-N-(2-propan-2-ylphenyl)pyridazine-3-carboxamide
CID 62236502
N-butyl-N-methyl-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide
CID 109125688
N-(furan-2-ylmethyl)-6-[4-(4-methylpiperidin-1-yl)anilino]pyridazine-3-carboxamide
CID 109117644

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide?
The IUPAC name of N-(furan-2-ylmethyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide (CID 109117595) is N-(furan-2-ylmethyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide?
The canonical SMILES for N-(furan-2-ylmethyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide is CC(C)c1ccccc1Nc1ccc(C(=O)NCc2ccco2)nn1.
What is the InChIKey of N-(furan-2-ylmethyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide?
The InChIKey is UZMLKZUJFZHDOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-13(2)15-7-3-4-8-16(15)21-18-10-9-17(22-23-18)19(24)20-12-14-6-5-11-25-14/h3-11,13H,12H2,1-2H3,(H,20,24)(H,21,23).
What are the key properties of N-(furan-2-ylmethyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide?
N-(furan-2-ylmethyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide has a molecular weight of 336.40 g/mol, XLogP of 3.87, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide is sourced from PubChem (CID 109117595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).