4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyrazin-2-yloxycyclohexyl)benzamide

C20H21N5O3 — CID 126778156

IUPAC4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyrazin-2-yloxycyclohexyl)benzamide
SMILESCc1noc(-c2ccc(C(=O)NC3CCC(Oc4cnccn4)CC3)cc2)n1
InChIInChI=1S/C20H21N5O3/c1-13-23-20(28-25-13)15-4-2-14(3-5-15)19(26)24-16-6-8-17(9-7-16)27-18-12-21-10-11-22-18/h2-5,10-12,16-17H,6-9H2,1H3,(H,24,26)
InChIKeyBSEWLPBVIDNJQO-UHFFFAOYSA-N
MW379.42 g/mol
LogP2.96
Rot. Bonds5

About 4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyrazin-2-yloxycyclohexyl)benzamide

4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyrazin-2-yloxycyclohexyl)benzamide (PubChem CID 126778156) has the molecular formula C20H21N5O3 and a molecular weight of 379.42 g/mol. Its IUPAC name is 4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyrazin-2-yloxycyclohexyl)benzamide.

Molecular Properties

Compound Name4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyrazin-2-yloxycyclohexyl)benzamide
PubChem CID126778156
Molecular FormulaC20H21N5O3
Molecular Weight379.42 g/mol
Exact Mass379.16
IUPAC Name4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyrazin-2-yloxycyclohexyl)benzamide
SMILESCc1noc(-c2ccc(C(=O)NC3CCC(Oc4cnccn4)CC3)cc2)n1
InChIInChI=1S/C20H21N5O3/c1-13-23-20(28-25-13)15-4-2-14(3-5-15)19(26)24-16-6-8-17(9-7-16)27-18-12-21-10-11-22-18/h2-5,10-12,16-17H,6-9H2,1H3,(H,24,26)
InChIKeyBSEWLPBVIDNJQO-UHFFFAOYSA-N
XLogP2.96
TPSA103.03 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 ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5-methyl-N-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-4-carboxamide
CID 91626087
N-(4-pyrazin-2-yloxycyclohexyl)-1,2-oxazole-5-carboxamide
CID 91626018
N-(4-pyrazin-2-yloxycyclohexyl)furan-2-carboxamide
CID 91626044
2-cyclopentyl-N-(4-pyrazin-2-yloxycyclohexyl)acetamide
CID 91626028
N-cyclopropyl-5-methyl-1-[4-(3-methyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]pyrazole-4-carboxamide
CID 53178942
2-(3-chloro-2-methylphenoxy)-N-(4-pyrazin-2-yloxycyclohexyl)acetamide
CID 154754030
N-cyclopropyl-4-(5-methyl-1,3,4-oxadiazol-2-yl)benzamide
CID 110693154
N-cycloheptyl-5-(4-methylphenyl)-1,2,4-oxadiazole-3-carboxamide
CID 4175475
N-[4-(4,6-dimethylpyrimidin-2-yl)oxycyclohexyl]-5-pyridin-3-yl-1,2-oxazole-3-carboxamide
CID 90634871
2-phenylmethoxy-N-(4-pyrazin-2-yloxycyclohexyl)acetamide
CID 91626095
1-methyl-5-oxo-N-(4-pyrazin-2-yloxycyclohexyl)pyrrolidine-3-carboxamide
CID 91626098
N-cyclobutyl-4-methylbenzamide
CID 23530676

Frequently Asked Questions

What is the IUPAC name of 4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyrazin-2-yloxycyclohexyl)benzamide?
The IUPAC name of 4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyrazin-2-yloxycyclohexyl)benzamide (CID 126778156) is 4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyrazin-2-yloxycyclohexyl)benzamide.
What is the SMILES notation for 4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyrazin-2-yloxycyclohexyl)benzamide?
The canonical SMILES for 4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyrazin-2-yloxycyclohexyl)benzamide is Cc1noc(-c2ccc(C(=O)NC3CCC(Oc4cnccn4)CC3)cc2)n1.
What is the InChIKey of 4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyrazin-2-yloxycyclohexyl)benzamide?
The InChIKey is BSEWLPBVIDNJQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5O3/c1-13-23-20(28-25-13)15-4-2-14(3-5-15)19(26)24-16-6-8-17(9-7-16)27-18-12-21-10-11-22-18/h2-5,10-12,16-17H,6-9H2,1H3,(H,24,26).
What are the key properties of 4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyrazin-2-yloxycyclohexyl)benzamide?
4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyrazin-2-yloxycyclohexyl)benzamide has a molecular weight of 379.42 g/mol, XLogP of 2.96, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methyl-1,2,4-oxadiazol-5-yl)-N-(4-pyrazin-2-yloxycyclohexyl)benzamide is sourced from PubChem (CID 126778156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).