N-(4-methylcyclohexyl)-6-oxo-1-propylpyridazine-3-carboxamide

C15H23N3O2 — CID 2541694

IUPACN-(4-methylcyclohexyl)-6-oxo-1-propylpyridazine-3-carboxamide
SMILESCCCn1nc(C(=O)NC2CCC(C)CC2)ccc1=O
InChIInChI=1S/C15H23N3O2/c1-3-10-18-14(19)9-8-13(17-18)15(20)16-12-6-4-11(2)5-7-12/h8-9,11-12H,3-7,10H2,1-2H3,(H,16,20)
InChIKeyNNLRQUOJBGFSGA-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.96
Rot. Bonds4

About N-(4-methylcyclohexyl)-6-oxo-1-propylpyridazine-3-carboxamide

N-(4-methylcyclohexyl)-6-oxo-1-propylpyridazine-3-carboxamide (PubChem CID 2541694) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(4-methylcyclohexyl)-6-oxo-1-propylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(4-methylcyclohexyl)-6-oxo-1-propylpyridazine-3-carboxamide
PubChem CID2541694
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-(4-methylcyclohexyl)-6-oxo-1-propylpyridazine-3-carboxamide
SMILESCCCn1nc(C(=O)NC2CCC(C)CC2)ccc1=O
InChIInChI=1S/C15H23N3O2/c1-3-10-18-14(19)9-8-13(17-18)15(20)16-12-6-4-11(2)5-7-12/h8-9,11-12H,3-7,10H2,1-2H3,(H,16,20)
InChIKeyNNLRQUOJBGFSGA-UHFFFAOYSA-N
XLogP1.96
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclooctyl-6-oxo-1-propylpyridazine-3-carboxamide
CID 39724166
1-butyl-N-cycloheptyl-6-oxopyridazine-3-carboxamide
CID 42161985
6-oxo-N-(6-oxopiperidin-3-yl)-1-propylpyridazine-3-carboxamide
CID 62896815
1-butyl-N-[4-(2-methylbutan-2-yl)cyclohexyl]-6-oxopyridazine-3-carboxamide
CID 134029553
N-[2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]ethyl]-6-oxo-1-propylpyridazine-3-carboxamide
CID 94025908
[2-(cyclopentylamino)-2-oxoethyl] 6-oxo-1-propylpyridazine-3-carboxylate
CID 18080249
6-oxo-N-pentan-3-yl-1-propylpyridazine-3-carboxamide
CID 78784702
6-oxo-1-propyl-N-(8-tricyclo[5.2.1.02,6]decanyl)pyridazine-3-carboxamide
CID 43063119
1-butyl-N-(3,3-dimethylcyclopentyl)-6-oxopyridazine-3-carboxamide
CID 115880517
N-(2-cyclopentyl-2-hydroxyethyl)-6-oxo-1-propylpyridazine-3-carboxamide
CID 111426020
(2R)-2-[(6-oxo-1-propylpyridazine-3-carbonyl)amino]propanoic acid
CID 54990747
2-[(6-oxo-1-propylpyridazine-3-carbonyl)amino]propanoic acid
CID 43355382

Frequently Asked Questions

What is the IUPAC name of N-(4-methylcyclohexyl)-6-oxo-1-propylpyridazine-3-carboxamide?
The IUPAC name of N-(4-methylcyclohexyl)-6-oxo-1-propylpyridazine-3-carboxamide (CID 2541694) is N-(4-methylcyclohexyl)-6-oxo-1-propylpyridazine-3-carboxamide.
What is the SMILES notation for N-(4-methylcyclohexyl)-6-oxo-1-propylpyridazine-3-carboxamide?
The canonical SMILES for N-(4-methylcyclohexyl)-6-oxo-1-propylpyridazine-3-carboxamide is CCCn1nc(C(=O)NC2CCC(C)CC2)ccc1=O.
What is the InChIKey of N-(4-methylcyclohexyl)-6-oxo-1-propylpyridazine-3-carboxamide?
The InChIKey is NNLRQUOJBGFSGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-3-10-18-14(19)9-8-13(17-18)15(20)16-12-6-4-11(2)5-7-12/h8-9,11-12H,3-7,10H2,1-2H3,(H,16,20).
What are the key properties of N-(4-methylcyclohexyl)-6-oxo-1-propylpyridazine-3-carboxamide?
N-(4-methylcyclohexyl)-6-oxo-1-propylpyridazine-3-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylcyclohexyl)-6-oxo-1-propylpyridazine-3-carboxamide is sourced from PubChem (CID 2541694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).