N-tert-butyl-6-(5-hydroxy-3-methoxy-4-methyl-2-oxoimidazolidin-1-yl)pyridazine-3-carboxamide

C14H21N5O4 — CID 122543002

IUPACN-tert-butyl-6-(5-hydroxy-3-methoxy-4-methyl-2-oxoimidazolidin-1-yl)pyridazine-3-carboxamide
SMILESCON1C(=O)N(c2ccc(C(=O)NC(C)(C)C)nn2)C(O)C1C
InChIInChI=1S/C14H21N5O4/c1-8-12(21)18(13(22)19(8)23-5)10-7-6-9(16-17-10)11(20)15-14(2,3)4/h6-8,12,21H,1-5H3,(H,15,20)
InChIKeyXIZHDDYKZSYOJM-UHFFFAOYSA-N
MW323.35 g/mol
LogP0.52
Rot. Bonds3

About N-tert-butyl-6-(5-hydroxy-3-methoxy-4-methyl-2-oxoimidazolidin-1-yl)pyridazine-3-carboxamide

N-tert-butyl-6-(5-hydroxy-3-methoxy-4-methyl-2-oxoimidazolidin-1-yl)pyridazine-3-carboxamide (PubChem CID 122543002) has the molecular formula C14H21N5O4 and a molecular weight of 323.35 g/mol. Its IUPAC name is N-tert-butyl-6-(5-hydroxy-3-methoxy-4-methyl-2-oxoimidazolidin-1-yl)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-6-(5-hydroxy-3-methoxy-4-methyl-2-oxoimidazolidin-1-yl)pyridazine-3-carboxamide
PubChem CID122543002
Molecular FormulaC14H21N5O4
Molecular Weight323.35 g/mol
Exact Mass323.16
IUPAC NameN-tert-butyl-6-(5-hydroxy-3-methoxy-4-methyl-2-oxoimidazolidin-1-yl)pyridazine-3-carboxamide
SMILESCON1C(=O)N(c2ccc(C(=O)NC(C)(C)C)nn2)C(O)C1C
InChIInChI=1S/C14H21N5O4/c1-8-12(21)18(13(22)19(8)23-5)10-7-6-9(16-17-10)11(20)15-14(2,3)4/h6-8,12,21H,1-5H3,(H,15,20)
InChIKeyXIZHDDYKZSYOJM-UHFFFAOYSA-N
XLogP0.52
TPSA107.89 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.35
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-tert-butyl-6-(5-hydroxy-3,4-dimethyl-2-oxoimidazolidin-1-yl)pyridazine-3-carboxamide
CID 118072283
3-N,6-N-ditert-butylpyridazine-3,6-dicarboxamide
CID 139234600
N-tert-butyl-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109124840
N-tert-butyl-6-(methylamino)pyridazine-3-carboxamide
CID 62173045
N-tert-butyl-6-phenylpyridazine-3-carboxamide
CID 113200586
N-tert-butyl-6-(4-methylanilino)pyridazine-3-carboxamide
CID 109124849
N-tert-butyl-6-[(2-methoxyphenyl)methylamino]pyridazine-3-carboxamide
CID 109119978
N-tert-butyl-6-(2,6-dimethylanilino)pyridazine-3-carboxamide
CID 109124857
2-phenyl-2-[(6-pyrrolidin-1-ylpyridazine-3-carbonyl)amino]propanoic acid
CID 136552822
methyl 6-[[3-(tert-butylamino)-3-oxopropyl]amino]pyridazine-3-carboxylate
CID 115609127
N-tert-butyl-6-(3,4-dichloroanilino)pyridazine-3-carboxamide
CID 109124934
N-tert-butyl-6-(3-methylanilino)pyridazine-3-carboxamide
CID 109124848

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-6-(5-hydroxy-3-methoxy-4-methyl-2-oxoimidazolidin-1-yl)pyridazine-3-carboxamide?
The IUPAC name of N-tert-butyl-6-(5-hydroxy-3-methoxy-4-methyl-2-oxoimidazolidin-1-yl)pyridazine-3-carboxamide (CID 122543002) is N-tert-butyl-6-(5-hydroxy-3-methoxy-4-methyl-2-oxoimidazolidin-1-yl)pyridazine-3-carboxamide.
What is the SMILES notation for N-tert-butyl-6-(5-hydroxy-3-methoxy-4-methyl-2-oxoimidazolidin-1-yl)pyridazine-3-carboxamide?
The canonical SMILES for N-tert-butyl-6-(5-hydroxy-3-methoxy-4-methyl-2-oxoimidazolidin-1-yl)pyridazine-3-carboxamide is CON1C(=O)N(c2ccc(C(=O)NC(C)(C)C)nn2)C(O)C1C.
What is the InChIKey of N-tert-butyl-6-(5-hydroxy-3-methoxy-4-methyl-2-oxoimidazolidin-1-yl)pyridazine-3-carboxamide?
The InChIKey is XIZHDDYKZSYOJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5O4/c1-8-12(21)18(13(22)19(8)23-5)10-7-6-9(16-17-10)11(20)15-14(2,3)4/h6-8,12,21H,1-5H3,(H,15,20).
What are the key properties of N-tert-butyl-6-(5-hydroxy-3-methoxy-4-methyl-2-oxoimidazolidin-1-yl)pyridazine-3-carboxamide?
N-tert-butyl-6-(5-hydroxy-3-methoxy-4-methyl-2-oxoimidazolidin-1-yl)pyridazine-3-carboxamide has a molecular weight of 323.35 g/mol, XLogP of 0.52, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-6-(5-hydroxy-3-methoxy-4-methyl-2-oxoimidazolidin-1-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 122543002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).