N,3-dicyclopropyl-1,2,4-oxadiazol-5-amine

C8H11N3O — CID 62594867

IUPACN,3-dicyclopropyl-1,2,4-oxadiazol-5-amine
SMILESC1CC1Nc1nc(C2CC2)no1
InChIInChI=1S/C8H11N3O/c1-2-5(1)7-10-8(12-11-7)9-6-3-4-6/h5-6H,1-4H2,(H,9,10,11)
InChIKeyULLOTPLXXLMUHS-UHFFFAOYSA-N
MW165.20 g/mol
LogP1.52
Rot. Bonds3

About N,3-dicyclopropyl-1,2,4-oxadiazol-5-amine

N,3-dicyclopropyl-1,2,4-oxadiazol-5-amine (PubChem CID 62594867) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is N,3-dicyclopropyl-1,2,4-oxadiazol-5-amine.

Molecular Properties

Compound NameN,3-dicyclopropyl-1,2,4-oxadiazol-5-amine
PubChem CID62594867
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC NameN,3-dicyclopropyl-1,2,4-oxadiazol-5-amine
SMILESC1CC1Nc1nc(C2CC2)no1
InChIInChI=1S/C8H11N3O/c1-2-5(1)7-10-8(12-11-7)9-6-3-4-6/h5-6H,1-4H2,(H,9,10,11)
InChIKeyULLOTPLXXLMUHS-UHFFFAOYSA-N
XLogP1.52
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopropyl-3-(2,3-dihydro-1H-inden-2-yl)-1,2,4-oxadiazol-5-amine
CID 65405431
3-cyclopropyl-N-(2,2-dimethylcyclopropyl)-1,2,4-oxadiazol-5-amine
CID 130927334
N-cyclopropyl-3-(1,4-dioxan-2-yl)-1,2,4-oxadiazol-5-amine
CID 65351537
N-cyclopropyl-3-(1,4-oxathian-2-yl)-1,2,4-oxadiazol-5-amine
CID 79969966
(3-cyclohexyl-1,2,4-oxadiazol-5-yl)hydrazine
CID 62596343
N'-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)ethane-1,2-diamine
CID 83827051
N-methyl-3-(3-methylcyclopentyl)-1,2,4-oxadiazol-5-amine
CID 65413630
(1S,3S,5S)-3-[(3-cyclobutyl-1,2,4-oxadiazol-5-yl)amino]bicyclo[3.1.0]hexane-1-carboxylic acid
CID 166258923
3-cyclopropyl-N-[(1-methylcyclopropyl)methyl]-1,2,4-oxadiazol-5-amine
CID 131005374
3-cyclobutyl-N-ethyl-1,2,4-oxadiazol-5-amine
CID 64985459
3-[(3-cyclopropyl-1,2,4-oxadiazol-5-yl)amino]propanoic acid
CID 83831304
N-cyclopropyl-3-(2,2,2-trifluoroethyl)-1,2,4-oxadiazol-5-amine
CID 62594311

Frequently Asked Questions

What is the IUPAC name of N,3-dicyclopropyl-1,2,4-oxadiazol-5-amine?
The IUPAC name of N,3-dicyclopropyl-1,2,4-oxadiazol-5-amine (CID 62594867) is N,3-dicyclopropyl-1,2,4-oxadiazol-5-amine.
What is the SMILES notation for N,3-dicyclopropyl-1,2,4-oxadiazol-5-amine?
The canonical SMILES for N,3-dicyclopropyl-1,2,4-oxadiazol-5-amine is C1CC1Nc1nc(C2CC2)no1.
What is the InChIKey of N,3-dicyclopropyl-1,2,4-oxadiazol-5-amine?
The InChIKey is ULLOTPLXXLMUHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c1-2-5(1)7-10-8(12-11-7)9-6-3-4-6/h5-6H,1-4H2,(H,9,10,11).
What are the key properties of N,3-dicyclopropyl-1,2,4-oxadiazol-5-amine?
N,3-dicyclopropyl-1,2,4-oxadiazol-5-amine has a molecular weight of 165.20 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dicyclopropyl-1,2,4-oxadiazol-5-amine is sourced from PubChem (CID 62594867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).