6-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)pyridazine-3-carboxamide

C11H13N5O2 — CID 114186935

IUPAC6-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)pyridazine-3-carboxamide
SMILESCCNc1ccc(C(=O)NCc2ccno2)nn1
InChIInChI=1S/C11H13N5O2/c1-2-12-10-4-3-9(15-16-10)11(17)13-7-8-5-6-14-18-8/h3-6H,2,7H2,1H3,(H,12,16)(H,13,17)
InChIKeyKQZCBCWQBZRENT-UHFFFAOYSA-N
MW247.26 g/mol
LogP0.83
Rot. Bonds5

About 6-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)pyridazine-3-carboxamide

6-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)pyridazine-3-carboxamide (PubChem CID 114186935) has the molecular formula C11H13N5O2 and a molecular weight of 247.26 g/mol. Its IUPAC name is 6-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)pyridazine-3-carboxamide
PubChem CID114186935
Molecular FormulaC11H13N5O2
Molecular Weight247.26 g/mol
Exact Mass247.11
IUPAC Name6-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)pyridazine-3-carboxamide
SMILESCCNc1ccc(C(=O)NCc2ccno2)nn1
InChIInChI=1S/C11H13N5O2/c1-2-12-10-4-3-9(15-16-10)11(17)13-7-8-5-6-14-18-8/h3-6H,2,7H2,1H3,(H,12,16)(H,13,17)
InChIKeyKQZCBCWQBZRENT-UHFFFAOYSA-N
XLogP0.83
TPSA92.94 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.26
LogP ≤ 50.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-hydrazinyl-N-(1,2-oxazol-5-ylmethyl)pyridazine-3-carboxamide
CID 106423177
6-(ethylamino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide
CID 62172875
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-6-(ethylamino)pyridazine-3-carboxamide
CID 106377368
6-(ethylamino)-N-[2-(ethylamino)-2-oxoethyl]pyridazine-3-carboxamide
CID 55047399
6-(ethylamino)-N-[(4-methyl-1,2,4-triazol-3-yl)methyl]pyridazine-3-carboxamide
CID 62180418
6-(ethylamino)-N-[(1-methylpyrazol-3-yl)methyl]pyridazine-3-carboxamide
CID 82875427
N-(1,2-oxazol-5-ylmethyl)pyridine-2-carboxamide
CID 140748316
2-(ethylamino)-2-methyl-N-(1,2-oxazol-5-ylmethyl)propanamide
CID 106417135
6-(ethylamino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide
CID 62186107
N-(1,2-oxazol-5-ylmethyl)acetamide
CID 103939766
6-(ethylamino)-N-(oxan-2-ylmethyl)pyridazine-3-carboxamide
CID 62181516
1-tert-butyl-3-(1,2-oxazol-5-ylmethyl)urea
CID 106415604

Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)pyridazine-3-carboxamide (CID 114186935) is 6-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)pyridazine-3-carboxamide is CCNc1ccc(C(=O)NCc2ccno2)nn1.
What is the InChIKey of 6-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)pyridazine-3-carboxamide?
The InChIKey is KQZCBCWQBZRENT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N5O2/c1-2-12-10-4-3-9(15-16-10)11(17)13-7-8-5-6-14-18-8/h3-6H,2,7H2,1H3,(H,12,16)(H,13,17).
What are the key properties of 6-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)pyridazine-3-carboxamide?
6-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)pyridazine-3-carboxamide has a molecular weight of 247.26 g/mol, XLogP of 0.83, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-N-(1,2-oxazol-5-ylmethyl)pyridazine-3-carboxamide is sourced from PubChem (CID 114186935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).