N-cyclopentyl-3-(3-methyl-1-phenylpyrazol-4-yl)-1,2,4-oxadiazole-5-carboxamide

C18H19N5O2 — CID 20931695

IUPACN-cyclopentyl-3-(3-methyl-1-phenylpyrazol-4-yl)-1,2,4-oxadiazole-5-carboxamide
SMILESCc1nn(-c2ccccc2)cc1-c1noc(C(=O)NC2CCCC2)n1
InChIInChI=1S/C18H19N5O2/c1-12-15(11-23(21-12)14-9-3-2-4-10-14)16-20-18(25-22-16)17(24)19-13-7-5-6-8-13/h2-4,9-11,13H,5-8H2,1H3,(H,19,24)
InChIKeyMWBIPEJLIHYJRX-UHFFFAOYSA-N
MW337.38 g/mol
LogP2.90
Rot. Bonds4

About N-cyclopentyl-3-(3-methyl-1-phenylpyrazol-4-yl)-1,2,4-oxadiazole-5-carboxamide

N-cyclopentyl-3-(3-methyl-1-phenylpyrazol-4-yl)-1,2,4-oxadiazole-5-carboxamide (PubChem CID 20931695) has the molecular formula C18H19N5O2 and a molecular weight of 337.38 g/mol. Its IUPAC name is N-cyclopentyl-3-(3-methyl-1-phenylpyrazol-4-yl)-1,2,4-oxadiazole-5-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-3-(3-methyl-1-phenylpyrazol-4-yl)-1,2,4-oxadiazole-5-carboxamide
PubChem CID20931695
Molecular FormulaC18H19N5O2
Molecular Weight337.38 g/mol
Exact Mass337.15
IUPAC NameN-cyclopentyl-3-(3-methyl-1-phenylpyrazol-4-yl)-1,2,4-oxadiazole-5-carboxamide
SMILESCc1nn(-c2ccccc2)cc1-c1noc(C(=O)NC2CCCC2)n1
InChIInChI=1S/C18H19N5O2/c1-12-15(11-23(21-12)14-9-3-2-4-10-14)16-20-18(25-22-16)17(24)19-13-7-5-6-8-13/h2-4,9-11,13H,5-8H2,1H3,(H,19,24)
InChIKeyMWBIPEJLIHYJRX-UHFFFAOYSA-N
XLogP2.90
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-cyclopentyl-3-[1-(4-fluorophenyl)-3-methylpyrazol-4-yl]-1,2,4-oxadiazole-5-carboxamide
CID 20931773
N-(1-benzylpiperidin-4-yl)-3-[1-(4-chlorophenyl)-3-methylpyrazol-4-yl]-1,2,4-oxadiazole-5-carboxamide
CID 20931840
N-benzyl-3-[1-(4-bromophenyl)-3-methylpyrazol-4-yl]-1,2,4-oxadiazole-5-carboxamide
CID 20931756
3-[1-(4-chlorophenyl)-3-methylpyrazol-4-yl]-N-(oxolan-2-ylmethyl)-1,2,4-oxadiazole-5-carboxamide
CID 20931833
N-cyclopentyl-3-(1H-indol-3-yl)-1,2,4-oxadiazole-5-carboxamide
CID 135636045
3-[1-(4-chlorophenyl)-3-methylpyrazol-4-yl]-N-(2-methoxyethyl)-1,2,4-oxadiazole-5-carboxamide
CID 20931834
3-[1-(4-bromophenyl)-3-methylpyrazol-4-yl]-N-(3-methylbutyl)-1,2,4-oxadiazole-5-carboxamide
CID 20931746
N-cycloheptyl-3-(3-methylphenyl)-1,2,4-oxadiazole-5-carboxamide
CID 6471248
N-cyclohexyl-1-phenyl-1,2,4-triazole-3-carboxamide
CID 42880791
[3-[1-(4-bromophenyl)-3-methylpyrazol-4-yl]-1,2,4-oxadiazol-5-yl]-(3,4-dihydro-1H-isoquinolin-2-yl)methanone
CID 20931744
3-[1-(4-chlorophenyl)-3-methylpyrazol-4-yl]-N-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propyl]-1,2,4-oxadiazole-5-carboxamide
CID 20931848
N-cyclopentyl-3-[4-(4-methylpiperidin-1-yl)phenyl]-1,2,4-oxadiazole-5-carboxamide
CID 50827804

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-(3-methyl-1-phenylpyrazol-4-yl)-1,2,4-oxadiazole-5-carboxamide?
The IUPAC name of N-cyclopentyl-3-(3-methyl-1-phenylpyrazol-4-yl)-1,2,4-oxadiazole-5-carboxamide (CID 20931695) is N-cyclopentyl-3-(3-methyl-1-phenylpyrazol-4-yl)-1,2,4-oxadiazole-5-carboxamide.
What is the SMILES notation for N-cyclopentyl-3-(3-methyl-1-phenylpyrazol-4-yl)-1,2,4-oxadiazole-5-carboxamide?
The canonical SMILES for N-cyclopentyl-3-(3-methyl-1-phenylpyrazol-4-yl)-1,2,4-oxadiazole-5-carboxamide is Cc1nn(-c2ccccc2)cc1-c1noc(C(=O)NC2CCCC2)n1.
What is the InChIKey of N-cyclopentyl-3-(3-methyl-1-phenylpyrazol-4-yl)-1,2,4-oxadiazole-5-carboxamide?
The InChIKey is MWBIPEJLIHYJRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O2/c1-12-15(11-23(21-12)14-9-3-2-4-10-14)16-20-18(25-22-16)17(24)19-13-7-5-6-8-13/h2-4,9-11,13H,5-8H2,1H3,(H,19,24).
What are the key properties of N-cyclopentyl-3-(3-methyl-1-phenylpyrazol-4-yl)-1,2,4-oxadiazole-5-carboxamide?
N-cyclopentyl-3-(3-methyl-1-phenylpyrazol-4-yl)-1,2,4-oxadiazole-5-carboxamide has a molecular weight of 337.38 g/mol, XLogP of 2.90, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-(3-methyl-1-phenylpyrazol-4-yl)-1,2,4-oxadiazole-5-carboxamide is sourced from PubChem (CID 20931695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).