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

C16H15N5O2 — CID 133343449

IUPACN-methyl-6-[(5-phenyl-1,2-oxazol-3-yl)methylamino]pyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(NCc2cc(-c3ccccc3)on2)nn1
InChIInChI=1S/C16H15N5O2/c1-17-16(22)13-7-8-15(20-19-13)18-10-12-9-14(23-21-12)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,17,22)(H,18,20)
InChIKeyYZACFYVELCMGIT-UHFFFAOYSA-N
MW309.33 g/mol
LogP2.10
Rot. Bonds5

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

N-methyl-6-[(5-phenyl-1,2-oxazol-3-yl)methylamino]pyridazine-3-carboxamide (PubChem CID 133343449) has the molecular formula C16H15N5O2 and a molecular weight of 309.33 g/mol. Its IUPAC name is N-methyl-6-[(5-phenyl-1,2-oxazol-3-yl)methylamino]pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-methyl-6-[(5-phenyl-1,2-oxazol-3-yl)methylamino]pyridazine-3-carboxamide
PubChem CID133343449
Molecular FormulaC16H15N5O2
Molecular Weight309.33 g/mol
Exact Mass309.12
IUPAC NameN-methyl-6-[(5-phenyl-1,2-oxazol-3-yl)methylamino]pyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(NCc2cc(-c3ccccc3)on2)nn1
InChIInChI=1S/C16H15N5O2/c1-17-16(22)13-7-8-15(20-19-13)18-10-12-9-14(23-21-12)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,17,22)(H,18,20)
InChIKeyYZACFYVELCMGIT-UHFFFAOYSA-N
XLogP2.10
TPSA92.94 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.33
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-methyl-3-nitro-4-[(5-phenyl-1,2-oxazol-3-yl)methylamino]benzamide
CID 133282891
N-methyl-6-[(1-methylpyrazol-3-yl)methylamino]pyridazine-3-carboxamide
CID 82874153
6-[[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylamino]-N-methylpyridazine-3-carboxamide
CID 133339646
N-methyl-6-(naphthalen-2-ylmethylamino)pyridazine-3-carboxamide
CID 133328883
2-phenyl-N-[(5-phenyl-1,2-oxazol-3-yl)methyl]acetamide
CID 16866545
N-methyl-6-[(4-phenoxyphenyl)methylamino]pyridazine-3-carboxamide
CID 133343379
N-methyl-6-[(4-phenylsulfanylphenyl)methylamino]pyridazine-3-carboxamide
CID 133397231
1-tert-butyl-N-[(5-phenyl-1,2-oxazol-3-yl)methyl]triazole-4-carboxamide
CID 126770892
N-methyl-6-(naphthalen-1-ylmethylamino)pyridazine-3-carboxamide
CID 133329112
2-methyl-N-[(5-phenyl-1,2-oxazol-3-yl)methyl]propan-2-amine
CID 112723924
2-nitro-N-[(5-phenyl-1,2-oxazol-3-yl)methyl]benzamide
CID 16866508
N-methyl-6-[(2-phenoxyphenyl)methylamino]pyridazine-3-carboxamide
CID 133329071

Frequently Asked Questions

What is the IUPAC name of N-methyl-6-[(5-phenyl-1,2-oxazol-3-yl)methylamino]pyridazine-3-carboxamide?
The IUPAC name of N-methyl-6-[(5-phenyl-1,2-oxazol-3-yl)methylamino]pyridazine-3-carboxamide (CID 133343449) is N-methyl-6-[(5-phenyl-1,2-oxazol-3-yl)methylamino]pyridazine-3-carboxamide.
What is the SMILES notation for N-methyl-6-[(5-phenyl-1,2-oxazol-3-yl)methylamino]pyridazine-3-carboxamide?
The canonical SMILES for N-methyl-6-[(5-phenyl-1,2-oxazol-3-yl)methylamino]pyridazine-3-carboxamide is CNC(=O)c1ccc(NCc2cc(-c3ccccc3)on2)nn1.
What is the InChIKey of N-methyl-6-[(5-phenyl-1,2-oxazol-3-yl)methylamino]pyridazine-3-carboxamide?
The InChIKey is YZACFYVELCMGIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N5O2/c1-17-16(22)13-7-8-15(20-19-13)18-10-12-9-14(23-21-12)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,17,22)(H,18,20).
What are the key properties of N-methyl-6-[(5-phenyl-1,2-oxazol-3-yl)methylamino]pyridazine-3-carboxamide?
N-methyl-6-[(5-phenyl-1,2-oxazol-3-yl)methylamino]pyridazine-3-carboxamide has a molecular weight of 309.33 g/mol, XLogP of 2.10, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-[(5-phenyl-1,2-oxazol-3-yl)methylamino]pyridazine-3-carboxamide is sourced from PubChem (CID 133343449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).