2-cyclohexyloxy-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]acetamide

C17H27N3O3 — CID 71917190

IUPAC2-cyclohexyloxy-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]acetamide
SMILESCCc1n[nH]c(=O)c(CNC(=O)COC2CCCCC2)c1CC
InChIInChI=1S/C17H27N3O3/c1-3-13-14(17(22)20-19-15(13)4-2)10-18-16(21)11-23-12-8-6-5-7-9-12/h12H,3-11H2,1-2H3,(H,18,21)(H,20,22)
InChIKeyMALHIUJEZGSZHP-UHFFFAOYSA-N
MW321.42 g/mol
LogP1.86
Rot. Bonds7

About 2-cyclohexyloxy-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]acetamide

2-cyclohexyloxy-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]acetamide (PubChem CID 71917190) has the molecular formula C17H27N3O3 and a molecular weight of 321.42 g/mol. Its IUPAC name is 2-cyclohexyloxy-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]acetamide.

Molecular Properties

Compound Name2-cyclohexyloxy-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]acetamide
PubChem CID71917190
Molecular FormulaC17H27N3O3
Molecular Weight321.42 g/mol
Exact Mass321.21
IUPAC Name2-cyclohexyloxy-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]acetamide
SMILESCCc1n[nH]c(=O)c(CNC(=O)COC2CCCCC2)c1CC
InChIInChI=1S/C17H27N3O3/c1-3-13-14(17(22)20-19-15(13)4-2)10-18-16(21)11-23-12-8-6-5-7-9-12/h12H,3-11H2,1-2H3,(H,18,21)(H,20,22)
InChIKeyMALHIUJEZGSZHP-UHFFFAOYSA-N
XLogP1.86
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.42
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]butanamide
CID 120873070
1-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]-3-ethylurea
CID 71846788
5-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methylcarbamoyl]thiophene-2-carboxylic acid
CID 120552216
N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]-4-(4-methyl-1,2,4-triazol-3-yl)piperidine-1-carboxamide
CID 127654977
2-cyclohexyloxy-N-(2-ethyl-2-hydroxybutyl)acetamide
CID 111483333
2-cyclohexyloxy-N-(5-methyl-1H-pyrazol-3-yl)acetamide
CID 47289841
2-cyclohexyloxy-N'-ethylacetohydrazide
CID 144767495
3-amino-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]-2-methyl-3-phenylpropanamide
CID 167840250
2-[[2-[(2-cyclooctyloxyacetyl)amino]acetyl]amino]acetic acid
CID 154992981
2-cyclopentyloxy-N-[2-(methylamino)ethyl]acetamide;hydrochloride
CID 119503016
5-(azocane-1-carbonyl)-3,4-diethyl-1H-pyridazin-6-one
CID 71920567
3,4-diethyl-5-[[(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)amino]methyl]-1H-pyridazin-6-one
CID 133472543

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxy-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]acetamide?
The IUPAC name of 2-cyclohexyloxy-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]acetamide (CID 71917190) is 2-cyclohexyloxy-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]acetamide.
What is the SMILES notation for 2-cyclohexyloxy-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]acetamide?
The canonical SMILES for 2-cyclohexyloxy-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]acetamide is CCc1n[nH]c(=O)c(CNC(=O)COC2CCCCC2)c1CC.
What is the InChIKey of 2-cyclohexyloxy-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]acetamide?
The InChIKey is MALHIUJEZGSZHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O3/c1-3-13-14(17(22)20-19-15(13)4-2)10-18-16(21)11-23-12-8-6-5-7-9-12/h12H,3-11H2,1-2H3,(H,18,21)(H,20,22).
What are the key properties of 2-cyclohexyloxy-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]acetamide?
2-cyclohexyloxy-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]acetamide has a molecular weight of 321.42 g/mol, XLogP of 1.86, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-N-[(3,4-diethyl-6-oxo-1H-pyridazin-5-yl)methyl]acetamide is sourced from PubChem (CID 71917190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).