6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridazine-3-carboxamide

C12H14N4O2 — CID 62524620

IUPAC6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridazine-3-carboxamide
SMILESCNc1ccc(C(=O)NCc2ccc(C)o2)nn1
InChIInChI=1S/C12H14N4O2/c1-8-3-4-9(18-8)7-14-12(17)10-5-6-11(13-2)16-15-10/h3-6H,7H2,1-2H3,(H,13,16)(H,14,17)
InChIKeyGRPZPKYULBCVFQ-UHFFFAOYSA-N
MW246.27 g/mol
LogP1.35
Rot. Bonds4

About 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridazine-3-carboxamide

6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridazine-3-carboxamide (PubChem CID 62524620) has the molecular formula C12H14N4O2 and a molecular weight of 246.27 g/mol. Its IUPAC name is 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridazine-3-carboxamide
PubChem CID62524620
Molecular FormulaC12H14N4O2
Molecular Weight246.27 g/mol
Exact Mass246.11
IUPAC Name6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridazine-3-carboxamide
SMILESCNc1ccc(C(=O)NCc2ccc(C)o2)nn1
InChIInChI=1S/C12H14N4O2/c1-8-3-4-9(18-8)7-14-12(17)10-5-6-11(13-2)16-15-10/h3-6H,7H2,1-2H3,(H,13,16)(H,14,17)
InChIKeyGRPZPKYULBCVFQ-UHFFFAOYSA-N
XLogP1.35
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 51.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide
CID 62523594
5-(methylamino)-N-[(5-methylfuran-2-yl)methyl]-1,3,4-thiadiazole-2-carboxamide
CID 80616970
6-(methylamino)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]pyridazine-3-carboxamide
CID 62174780
5-carbamothioyl-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide
CID 63749387
6-(ethylamino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide
CID 62172875
N-(2-fluoroethyl)-6-(methylamino)pyridazine-3-carboxamide
CID 130504947
5-methyl-2-(methylamino)-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 62523940
1,5-dimethyl-N-[(5-methylfuran-2-yl)methyl]pyrazole-3-carboxamide
CID 39854570
4-N-[(5-methylfuran-2-yl)methyl]-1,3-thiazole-2,4-dicarboxamide
CID 53158295
2-methyl-N-[(5-methylfuran-2-yl)methyl]pyrazole-3-carboxamide
CID 131933266
4-chloro-N-[(5-methylfuran-2-yl)methyl]pyridine-2-carboxamide
CID 55081452
2-chloro-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 110731650

Frequently Asked Questions

What is the IUPAC name of 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridazine-3-carboxamide?
The IUPAC name of 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridazine-3-carboxamide (CID 62524620) is 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridazine-3-carboxamide.
What is the SMILES notation for 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridazine-3-carboxamide?
The canonical SMILES for 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridazine-3-carboxamide is CNc1ccc(C(=O)NCc2ccc(C)o2)nn1.
What is the InChIKey of 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridazine-3-carboxamide?
The InChIKey is GRPZPKYULBCVFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4O2/c1-8-3-4-9(18-8)7-14-12(17)10-5-6-11(13-2)16-15-10/h3-6H,7H2,1-2H3,(H,13,16)(H,14,17).
What are the key properties of 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridazine-3-carboxamide?
6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridazine-3-carboxamide has a molecular weight of 246.27 g/mol, XLogP of 1.35, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridazine-3-carboxamide is sourced from PubChem (CID 62524620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).