N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,2-oxazole-5-carboxamide

C19H19N5O3 — CID 126936200

IUPACN-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,2-oxazole-5-carboxamide
SMILESO=C(NC1CCC(n2nc(-c3cccnc3)ccc2=O)CC1)c1ccno1
InChIInChI=1S/C19H19N5O3/c25-18-8-7-16(13-2-1-10-20-12-13)23-24(18)15-5-3-14(4-6-15)22-19(26)17-9-11-21-27-17/h1-2,7-12,14-15H,3-6H2,(H,22,26)
InChIKeyUPZLJURJBAKZEG-UHFFFAOYSA-N
MW365.39 g/mol
LogP2.21
Rot. Bonds4

About N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,2-oxazole-5-carboxamide

N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,2-oxazole-5-carboxamide (PubChem CID 126936200) has the molecular formula C19H19N5O3 and a molecular weight of 365.39 g/mol. Its IUPAC name is N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,2-oxazole-5-carboxamide
PubChem CID126936200
Molecular FormulaC19H19N5O3
Molecular Weight365.39 g/mol
Exact Mass365.15
IUPAC NameN-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,2-oxazole-5-carboxamide
SMILESO=C(NC1CCC(n2nc(-c3cccnc3)ccc2=O)CC1)c1ccno1
InChIInChI=1S/C19H19N5O3/c25-18-8-7-16(13-2-1-10-20-12-13)23-24(18)15-5-3-14(4-6-15)22-19(26)17-9-11-21-27-17/h1-2,7-12,14-15H,3-6H2,(H,22,26)
InChIKeyUPZLJURJBAKZEG-UHFFFAOYSA-N
XLogP2.21
TPSA102.91 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-methyl-N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,2-oxazole-3-carboxamide
CID 126936222
2-methyl-N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]pyrazole-3-carboxamide
CID 126936292
1-methyl-6-oxo-N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]pyridazine-3-carboxamide
CID 126936204
N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]quinoxaline-2-carboxamide
CID 126936220
N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]oxolane-2-carboxamide
CID 126936236
2,4-dimethyl-N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,3-thiazole-5-carboxamide
CID 126936211
N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1H-indole-3-carboxamide
CID 126936213
6-pyridin-3-yl-2-[4-(pyridin-4-ylamino)cyclohexyl]pyridazin-3-one
CID 126936315
2-(1H-indol-3-yl)-N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]acetamide
CID 126936252
6-pyridin-3-yl-2-[4-[[5-(trifluoromethyl)-2-pyridinyl]amino]cyclohexyl]pyridazin-3-one
CID 126936312
N-[4-(1,2,4-triazol-4-yl)cyclohexyl]-1,2-oxazole-5-carboxamide
CID 56702942
2-[4-[(4,6-dimethylpyrimidin-2-yl)amino]cyclohexyl]-6-pyridin-3-ylpyridazin-3-one
CID 126936318

Frequently Asked Questions

What is the IUPAC name of N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,2-oxazole-5-carboxamide?
The IUPAC name of N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,2-oxazole-5-carboxamide (CID 126936200) is N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,2-oxazole-5-carboxamide is O=C(NC1CCC(n2nc(-c3cccnc3)ccc2=O)CC1)c1ccno1.
What is the InChIKey of N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,2-oxazole-5-carboxamide?
The InChIKey is UPZLJURJBAKZEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N5O3/c25-18-8-7-16(13-2-1-10-20-12-13)23-24(18)15-5-3-14(4-6-15)22-19(26)17-9-11-21-27-17/h1-2,7-12,14-15H,3-6H2,(H,22,26).
What are the key properties of N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,2-oxazole-5-carboxamide?
N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,2-oxazole-5-carboxamide has a molecular weight of 365.39 g/mol, XLogP of 2.21, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)cyclohexyl]-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 126936200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).