2-(1,3-dimethylpyrazol-4-yl)-5-propyl-1,3,4-oxadiazole

C10H14N4O — CID 170382996

IUPAC2-(1,3-dimethylpyrazol-4-yl)-5-propyl-1,3,4-oxadiazole
SMILESCCCc1nnc(-c2cn(C)nc2C)o1
InChIInChI=1S/C10H14N4O/c1-4-5-9-11-12-10(15-9)8-6-14(3)13-7(8)2/h6H,4-5H2,1-3H3
InChIKeyJYJHSUFXGBXQLZ-UHFFFAOYSA-N
MW206.25 g/mol
LogP1.73
Rot. Bonds3

About 2-(1,3-dimethylpyrazol-4-yl)-5-propyl-1,3,4-oxadiazole

2-(1,3-dimethylpyrazol-4-yl)-5-propyl-1,3,4-oxadiazole (PubChem CID 170382996) has the molecular formula C10H14N4O and a molecular weight of 206.25 g/mol. Its IUPAC name is 2-(1,3-dimethylpyrazol-4-yl)-5-propyl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(1,3-dimethylpyrazol-4-yl)-5-propyl-1,3,4-oxadiazole
PubChem CID170382996
Molecular FormulaC10H14N4O
Molecular Weight206.25 g/mol
Exact Mass206.12
IUPAC Name2-(1,3-dimethylpyrazol-4-yl)-5-propyl-1,3,4-oxadiazole
SMILESCCCc1nnc(-c2cn(C)nc2C)o1
InChIInChI=1S/C10H14N4O/c1-4-5-9-11-12-10(15-9)8-6-14(3)13-7(8)2/h6H,4-5H2,1-3H3
InChIKeyJYJHSUFXGBXQLZ-UHFFFAOYSA-N
XLogP1.73
TPSA56.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1,3-dimethylpyrazol-4-yl)-5-propan-2-yl-1,3,4-oxadiazole
CID 169163056
2-(2,5-difluoro-4-propan-2-ylphenyl)-5-propyl-1,3,4-oxadiazole
CID 58142760
2-phenyl-5-propyl-1,3,4-oxadiazole
CID 14949000
2-[2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole
CID 19550390
2-(2-chloroethyl)-5-(1,3-dimethylpyrazol-4-yl)-1,3-oxazole
CID 102802514
5-amino-2-(1,3-dimethylpyrazol-4-yl)-1,3-oxazole-4-carbonitrile
CID 102802554
2-(3-bromo-2-fluorophenyl)-5-propyl-1,3,4-oxadiazole
CID 107951358
3-(1-chlorobutyl)-5-(1,3-dimethylpyrazol-4-yl)-1,2,4-oxadiazole
CID 103096084
2-[5-bromo-2-(difluoromethoxy)phenyl]-5-(1,3-dimethylpyrazol-4-yl)-1,3,4-oxadiazole
CID 4866567
3-methoxy-4-(5-propyl-1,3,4-oxadiazol-2-yl)aniline
CID 113452620
5-(1,3-dimethylpyrazol-4-yl)-N,4-diethyl-1,2,4-triazol-3-amine
CID 102801445
3-[5-(1,3-dimethylpyrazol-4-yl)-1,3-oxazol-2-yl]propanoic acid
CID 65196994

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-dimethylpyrazol-4-yl)-5-propyl-1,3,4-oxadiazole?
The IUPAC name of 2-(1,3-dimethylpyrazol-4-yl)-5-propyl-1,3,4-oxadiazole (CID 170382996) is 2-(1,3-dimethylpyrazol-4-yl)-5-propyl-1,3,4-oxadiazole.
What is the SMILES notation for 2-(1,3-dimethylpyrazol-4-yl)-5-propyl-1,3,4-oxadiazole?
The canonical SMILES for 2-(1,3-dimethylpyrazol-4-yl)-5-propyl-1,3,4-oxadiazole is CCCc1nnc(-c2cn(C)nc2C)o1.
What is the InChIKey of 2-(1,3-dimethylpyrazol-4-yl)-5-propyl-1,3,4-oxadiazole?
The InChIKey is JYJHSUFXGBXQLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O/c1-4-5-9-11-12-10(15-9)8-6-14(3)13-7(8)2/h6H,4-5H2,1-3H3.
What are the key properties of 2-(1,3-dimethylpyrazol-4-yl)-5-propyl-1,3,4-oxadiazole?
2-(1,3-dimethylpyrazol-4-yl)-5-propyl-1,3,4-oxadiazole has a molecular weight of 206.25 g/mol, XLogP of 1.73, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-dimethylpyrazol-4-yl)-5-propyl-1,3,4-oxadiazole is sourced from PubChem (CID 170382996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).