6-oxo-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyridazine-3-carboxamide

C15H17N5O3 — CID 90633191

IUPAC6-oxo-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyridazine-3-carboxamide
SMILESO=C(NC1CCC(Oc2ncccn2)CC1)c1ccc(=O)[nH]n1
InChIInChI=1S/C15H17N5O3/c21-13-7-6-12(19-20-13)14(22)18-10-2-4-11(5-3-10)23-15-16-8-1-9-17-15/h1,6-11H,2-5H2,(H,18,22)(H,20,21)
InChIKeyFSYHEIZYCLLGRQ-UHFFFAOYSA-N
MW315.33 g/mol
LogP0.68
Rot. Bonds4

About 6-oxo-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyridazine-3-carboxamide

6-oxo-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyridazine-3-carboxamide (PubChem CID 90633191) has the molecular formula C15H17N5O3 and a molecular weight of 315.33 g/mol. Its IUPAC name is 6-oxo-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-oxo-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyridazine-3-carboxamide
PubChem CID90633191
Molecular FormulaC15H17N5O3
Molecular Weight315.33 g/mol
Exact Mass315.13
IUPAC Name6-oxo-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyridazine-3-carboxamide
SMILESO=C(NC1CCC(Oc2ncccn2)CC1)c1ccc(=O)[nH]n1
InChIInChI=1S/C15H17N5O3/c21-13-7-6-12(19-20-13)14(22)18-10-2-4-11(5-3-10)23-15-16-8-1-9-17-15/h1,6-11H,2-5H2,(H,18,22)(H,20,21)
InChIKeyFSYHEIZYCLLGRQ-UHFFFAOYSA-N
XLogP0.68
TPSA109.86 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.33
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-(furan-2-yl)-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyrazole-3-carboxamide
CID 90633194
3-phenyl-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyrazole-5-carboxamide
CID 90633193
N-(4-pyrimidin-2-yloxycyclohexyl)-1H-1,2,4-triazole-5-carboxamide
CID 90633421
N-(4-pyrimidin-2-yloxycyclohexyl)quinoxaline-2-carboxamide
CID 90633350
N-(1,1-dioxothian-4-yl)-6-oxo-1H-pyridazine-3-carboxamide
CID 113223754
N-cyclopent-3-en-1-yl-6-oxo-1H-pyridazine-3-carboxamide
CID 103762323
N-[4-(5-fluoropyrimidin-2-yl)oxycyclohexyl]pyridine-2-carboxamide
CID 91626394
6-oxo-N-(1-phenylpiperidin-4-yl)-1H-pyridazine-3-carboxamide
CID 110745882
N-(4-pyrimidin-2-yloxycyclohexyl)naphthalene-2-carboxamide
CID 90633284
5-chloro-N-(4-pyrimidin-2-yloxycyclohexyl)thiophene-2-carboxamide
CID 91626280
6-oxo-N-[3-(2,2,2-trifluoroethoxy)cyclohexyl]-1H-pyridazine-3-carboxamide
CID 42957235
(2R)-5-oxo-N-(4-pyrimidin-2-yloxycyclohexyl)pyrrolidine-2-carboxamide
CID 100749039

Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyridazine-3-carboxamide?
The IUPAC name of 6-oxo-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyridazine-3-carboxamide (CID 90633191) is 6-oxo-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyridazine-3-carboxamide.
What is the SMILES notation for 6-oxo-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyridazine-3-carboxamide?
The canonical SMILES for 6-oxo-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyridazine-3-carboxamide is O=C(NC1CCC(Oc2ncccn2)CC1)c1ccc(=O)[nH]n1.
What is the InChIKey of 6-oxo-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyridazine-3-carboxamide?
The InChIKey is FSYHEIZYCLLGRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O3/c21-13-7-6-12(19-20-13)14(22)18-10-2-4-11(5-3-10)23-15-16-8-1-9-17-15/h1,6-11H,2-5H2,(H,18,22)(H,20,21).
What are the key properties of 6-oxo-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyridazine-3-carboxamide?
6-oxo-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyridazine-3-carboxamide has a molecular weight of 315.33 g/mol, XLogP of 0.68, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-(4-pyrimidin-2-yloxycyclohexyl)-1H-pyridazine-3-carboxamide is sourced from PubChem (CID 90633191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).