6-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridazine-5-carboxamide

C15H23N3O2 — CID 23566951

IUPAC6-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridazine-5-carboxamide
SMILESCC1(C)CC(NC(=O)c2ccn[nH]c2=O)CC(C)(C)C1
InChIInChI=1S/C15H23N3O2/c1-14(2)7-10(8-15(3,4)9-14)17-12(19)11-5-6-16-18-13(11)20/h5-6,10H,7-9H2,1-4H3,(H,17,19)(H,18,20)
InChIKeyPYCRPGMIOZEINC-UHFFFAOYSA-N
MW277.37 g/mol
LogP2.10
Rot. Bonds2

About 6-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridazine-5-carboxamide

6-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridazine-5-carboxamide (PubChem CID 23566951) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is 6-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridazine-5-carboxamide.

Molecular Properties

Compound Name6-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridazine-5-carboxamide
PubChem CID23566951
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC Name6-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridazine-5-carboxamide
SMILESCC1(C)CC(NC(=O)c2ccn[nH]c2=O)CC(C)(C)C1
InChIInChI=1S/C15H23N3O2/c1-14(2)7-10(8-15(3,4)9-14)17-12(19)11-5-6-16-18-13(11)20/h5-6,10H,7-9H2,1-4H3,(H,17,19)(H,18,20)
InChIKeyPYCRPGMIOZEINC-UHFFFAOYSA-N
XLogP2.10
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-3-carboxamide
CID 103968313
6-methyl-4-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridine-3-carboxamide
CID 103933010
5-chloro-2-fluoro-N-(3,3,5,5-tetramethylcyclohexyl)benzamide
CID 103966065
2-fluoro-5-methyl-N-(3,3,5,5-tetramethylcyclohexyl)benzamide
CID 103966079
2-amino-3-chloro-N-(3,3,5,5-tetramethylcyclohexyl)benzamide
CID 103965097
6-amino-N-(3,3,5,5-tetramethylcyclohexyl)pyridazine-3-carboxamide
CID 103968311
2-(carbamoylamino)-N-[1-(6-oxo-1H-pyridazine-5-carbonyl)azetidin-3-yl]benzamide
CID 166396922
N-[(1S)-3,3-dimethylcyclohexyl]-2-oxo-1H-pyridine-3-carboxamide
CID 164630158
5-bromo-N-(3,3,5,5-tetramethylcyclohexyl)furan-2-carboxamide
CID 103966929
4-(bromomethyl)-N-(3,3,5,5-tetramethylcyclohexyl)benzamide
CID 102852021
5-hydrazinyl-N-(3,3,5,5-tetramethylcyclohexyl)pyridine-2-carboxamide
CID 104643035
4-hydroxy-3-methyl-N-(3,3,5,5-tetramethylcyclohexyl)benzamide
CID 107676803

Frequently Asked Questions

What is the IUPAC name of 6-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridazine-5-carboxamide?
The IUPAC name of 6-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridazine-5-carboxamide (CID 23566951) is 6-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridazine-5-carboxamide.
What is the SMILES notation for 6-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridazine-5-carboxamide?
The canonical SMILES for 6-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridazine-5-carboxamide is CC1(C)CC(NC(=O)c2ccn[nH]c2=O)CC(C)(C)C1.
What is the InChIKey of 6-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridazine-5-carboxamide?
The InChIKey is PYCRPGMIOZEINC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-14(2)7-10(8-15(3,4)9-14)17-12(19)11-5-6-16-18-13(11)20/h5-6,10H,7-9H2,1-4H3,(H,17,19)(H,18,20).
What are the key properties of 6-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridazine-5-carboxamide?
6-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridazine-5-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 2.10, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-(3,3,5,5-tetramethylcyclohexyl)-1H-pyridazine-5-carboxamide is sourced from PubChem (CID 23566951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).