5,6-diethyl-3-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]pyridazine-4-carbonitrile

C15H19N5O — CID 133373741

IUPAC5,6-diethyl-3-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]pyridazine-4-carbonitrile
SMILESCCc1nnc(N(C)Cc2cc(C)on2)c(C#N)c1CC
InChIInChI=1S/C15H19N5O/c1-5-12-13(8-16)15(18-17-14(12)6-2)20(4)9-11-7-10(3)21-19-11/h7H,5-6,9H2,1-4H3
InChIKeyUEZRYFAIUCIIQF-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.41
Rot. Bonds5

About 5,6-diethyl-3-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]pyridazine-4-carbonitrile

5,6-diethyl-3-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]pyridazine-4-carbonitrile (PubChem CID 133373741) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is 5,6-diethyl-3-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]pyridazine-4-carbonitrile.

Molecular Properties

Compound Name5,6-diethyl-3-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]pyridazine-4-carbonitrile
PubChem CID133373741
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name5,6-diethyl-3-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]pyridazine-4-carbonitrile
SMILESCCc1nnc(N(C)Cc2cc(C)on2)c(C#N)c1CC
InChIInChI=1S/C15H19N5O/c1-5-12-13(8-16)15(18-17-14(12)6-2)20(4)9-11-7-10(3)21-19-11/h7H,5-6,9H2,1-4H3
InChIKeyUEZRYFAIUCIIQF-UHFFFAOYSA-N
XLogP2.41
TPSA78.84 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5,6-diethyl-3-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]pyridazine-4-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5,6-diethyl-3-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]pyridazine-4-carbonitrile?
The IUPAC name of 5,6-diethyl-3-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]pyridazine-4-carbonitrile (CID 133373741) is 5,6-diethyl-3-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]pyridazine-4-carbonitrile.
What is the SMILES notation for 5,6-diethyl-3-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]pyridazine-4-carbonitrile?
The canonical SMILES for 5,6-diethyl-3-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]pyridazine-4-carbonitrile is CCc1nnc(N(C)Cc2cc(C)on2)c(C#N)c1CC.
What is the InChIKey of 5,6-diethyl-3-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]pyridazine-4-carbonitrile?
The InChIKey is UEZRYFAIUCIIQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-5-12-13(8-16)15(18-17-14(12)6-2)20(4)9-11-7-10(3)21-19-11/h7H,5-6,9H2,1-4H3.
What are the key properties of 5,6-diethyl-3-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]pyridazine-4-carbonitrile?
5,6-diethyl-3-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]pyridazine-4-carbonitrile has a molecular weight of 285.35 g/mol, XLogP of 2.41, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-diethyl-3-[methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]amino]pyridazine-4-carbonitrile is sourced from PubChem (CID 133373741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).