N-[(5-methyl-1,3-oxazol-2-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide

C10H10N4O3 — CID 110660295

IUPACN-[(5-methyl-1,3-oxazol-2-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide
SMILESCc1cnc(CNC(=O)c2ccc(=O)[nH]n2)o1
InChIInChI=1S/C10H10N4O3/c1-6-4-11-9(17-6)5-12-10(16)7-2-3-8(15)14-13-7/h2-4H,5H2,1H3,(H,12,16)(H,14,15)
InChIKeyIJTJFZXWXXGSEC-UHFFFAOYSA-N
MW234.22 g/mol
LogP-0.00
Rot. Bonds3

About N-[(5-methyl-1,3-oxazol-2-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide

N-[(5-methyl-1,3-oxazol-2-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide (PubChem CID 110660295) has the molecular formula C10H10N4O3 and a molecular weight of 234.22 g/mol. Its IUPAC name is N-[(5-methyl-1,3-oxazol-2-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-[(5-methyl-1,3-oxazol-2-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide
PubChem CID110660295
Molecular FormulaC10H10N4O3
Molecular Weight234.22 g/mol
Exact Mass234.08
IUPAC NameN-[(5-methyl-1,3-oxazol-2-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide
SMILESCc1cnc(CNC(=O)c2ccc(=O)[nH]n2)o1
InChIInChI=1S/C10H10N4O3/c1-6-4-11-9(17-6)5-12-10(16)7-2-3-8(15)14-13-7/h2-4H,5H2,1H3,(H,12,16)(H,14,15)
InChIKeyIJTJFZXWXXGSEC-UHFFFAOYSA-N
XLogP-0.00
TPSA100.88 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.22
LogP ≤ 5-0.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1,3-oxazol-2-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide?
The IUPAC name of N-[(5-methyl-1,3-oxazol-2-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide (CID 110660295) is N-[(5-methyl-1,3-oxazol-2-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide.
What is the SMILES notation for N-[(5-methyl-1,3-oxazol-2-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide?
The canonical SMILES for N-[(5-methyl-1,3-oxazol-2-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide is Cc1cnc(CNC(=O)c2ccc(=O)[nH]n2)o1.
What is the InChIKey of N-[(5-methyl-1,3-oxazol-2-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide?
The InChIKey is IJTJFZXWXXGSEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O3/c1-6-4-11-9(17-6)5-12-10(16)7-2-3-8(15)14-13-7/h2-4H,5H2,1H3,(H,12,16)(H,14,15).
What are the key properties of N-[(5-methyl-1,3-oxazol-2-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide?
N-[(5-methyl-1,3-oxazol-2-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide has a molecular weight of 234.22 g/mol, XLogP of -0.00, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1,3-oxazol-2-yl)methyl]-6-oxo-1H-pyridazine-3-carboxamide is sourced from PubChem (CID 110660295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).