N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide

C20H21N5O3 — CID 55872142

IUPACN-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
SMILESCc1nc(C2(NC(=O)Cn3nc(-c4ccccc4)ccc3=O)CCCC2)no1
InChIInChI=1S/C20H21N5O3/c1-14-21-19(24-28-14)20(11-5-6-12-20)22-17(26)13-25-18(27)10-9-16(23-25)15-7-3-2-4-8-15/h2-4,7-10H,5-6,11-13H2,1H3,(H,22,26)
InChIKeyHQTPCTHAPCTJQA-UHFFFAOYSA-N
MW379.42 g/mol
LogP2.19
Rot. Bonds5

About N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide

N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide (PubChem CID 55872142) has the molecular formula C20H21N5O3 and a molecular weight of 379.42 g/mol. Its IUPAC name is N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide.

Molecular Properties

Compound NameN-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
PubChem CID55872142
Molecular FormulaC20H21N5O3
Molecular Weight379.42 g/mol
Exact Mass379.16
IUPAC NameN-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
SMILESCc1nc(C2(NC(=O)Cn3nc(-c4ccccc4)ccc3=O)CCCC2)no1
InChIInChI=1S/C20H21N5O3/c1-14-21-19(24-28-14)20(11-5-6-12-20)22-17(26)13-25-18(27)10-9-16(23-25)15-7-3-2-4-8-15/h2-4,7-10H,5-6,11-13H2,1H3,(H,22,26)
InChIKeyHQTPCTHAPCTJQA-UHFFFAOYSA-N
XLogP2.19
TPSA102.91 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.42
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

2-(6-oxo-3-phenylpyridazin-1-yl)-N-propan-2-ylacetamide
CID 5057313
N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]-2-(3-methyl-2-oxo-1-pyridinyl)acetamide
CID 71968872
2-ethoxy-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]acetamide
CID 52571685
N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(2-oxopiperidin-1-yl)acetamide
CID 78869869
2-[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]acetamide
CID 31163850
2-chloro-N-[3-[[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]amino]-3-oxo-1-phenylpropyl]benzamide
CID 55622366
2-[[2-[[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]amino]-2-oxoethyl]amino]benzamide
CID 139010784
N-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
CID 47865933
2-(2-benzylphenoxy)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]acetamide
CID 55672501
2-chloro-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclobutyl]acetamide
CID 166403701
2-(4-chlorophenyl)-N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cycloheptyl]acetamide
CID 71896477
N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-3-phenyl-4,5-dihydro-1,2-oxazole-5-carboxamide
CID 51079253

Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
The IUPAC name of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide (CID 55872142) is N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide.
What is the SMILES notation for N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
The canonical SMILES for N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide is Cc1nc(C2(NC(=O)Cn3nc(-c4ccccc4)ccc3=O)CCCC2)no1.
What is the InChIKey of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
The InChIKey is HQTPCTHAPCTJQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5O3/c1-14-21-19(24-28-14)20(11-5-6-12-20)22-17(26)13-25-18(27)10-9-16(23-25)15-7-3-2-4-8-15/h2-4,7-10H,5-6,11-13H2,1H3,(H,22,26).
What are the key properties of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide has a molecular weight of 379.42 g/mol, XLogP of 2.19, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclopentyl]-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide is sourced from PubChem (CID 55872142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).