6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide

C16H15N5O3 — CID 134604405

IUPAC6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide
SMILESCc1ccc(-c2noc(C)c2COc2ccc(C(N)=O)nn2)cn1
InChIInChI=1S/C16H15N5O3/c1-9-3-4-11(7-18-9)15-12(10(2)24-21-15)8-23-14-6-5-13(16(17)22)19-20-14/h3-7H,8H2,1-2H3,(H2,17,22)
InChIKeyVDLZNMPWETXSHJ-UHFFFAOYSA-N
MW325.33 g/mol
LogP1.82
Rot. Bonds5

About 6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide

6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide (PubChem CID 134604405) has the molecular formula C16H15N5O3 and a molecular weight of 325.33 g/mol. Its IUPAC name is 6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide
PubChem CID134604405
Molecular FormulaC16H15N5O3
Molecular Weight325.33 g/mol
Exact Mass325.12
IUPAC Name6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide
SMILESCc1ccc(-c2noc(C)c2COc2ccc(C(N)=O)nn2)cn1
InChIInChI=1S/C16H15N5O3/c1-9-3-4-11(7-18-9)15-12(10(2)24-21-15)8-23-14-6-5-13(16(17)22)19-20-14/h3-7H,8H2,1-2H3,(H2,17,22)
InChIKeyVDLZNMPWETXSHJ-UHFFFAOYSA-N
XLogP1.82
TPSA117.02 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.33
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide?
The IUPAC name of 6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide (CID 134604405) is 6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide.
What is the SMILES notation for 6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide?
The canonical SMILES for 6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide is Cc1ccc(-c2noc(C)c2COc2ccc(C(N)=O)nn2)cn1.
What is the InChIKey of 6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide?
The InChIKey is VDLZNMPWETXSHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O3/c1-9-3-4-11(7-18-9)15-12(10(2)24-21-15)8-23-14-6-5-13(16(17)22)19-20-14/h3-7H,8H2,1-2H3,(H2,17,22).
What are the key properties of 6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide?
6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide has a molecular weight of 325.33 g/mol, XLogP of 1.82, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[5-methyl-3-(6-methyl-3-pyridinyl)-1,2-oxazol-4-yl]methoxy]pyridazine-3-carboxamide is sourced from PubChem (CID 134604405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).