2-(5-propyl-1,2,4-oxadiazol-3-yl)pentan-2-amine

C10H19N3O — CID 43559532

IUPAC2-(5-propyl-1,2,4-oxadiazol-3-yl)pentan-2-amine
SMILESCCCc1nc(C(C)(N)CCC)no1
InChIInChI=1S/C10H19N3O/c1-4-6-8-12-9(13-14-8)10(3,11)7-5-2/h4-7,11H2,1-3H3
InChIKeyFIGRYUVQJHCZEV-UHFFFAOYSA-N
MW197.28 g/mol
LogP2.00
Rot. Bonds5

About 2-(5-propyl-1,2,4-oxadiazol-3-yl)pentan-2-amine

2-(5-propyl-1,2,4-oxadiazol-3-yl)pentan-2-amine (PubChem CID 43559532) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 2-(5-propyl-1,2,4-oxadiazol-3-yl)pentan-2-amine.

Molecular Properties

Compound Name2-(5-propyl-1,2,4-oxadiazol-3-yl)pentan-2-amine
PubChem CID43559532
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name2-(5-propyl-1,2,4-oxadiazol-3-yl)pentan-2-amine
SMILESCCCc1nc(C(C)(N)CCC)no1
InChIInChI=1S/C10H19N3O/c1-4-6-8-12-9(13-14-8)10(3,11)7-5-2/h4-7,11H2,1-3H3
InChIKeyFIGRYUVQJHCZEV-UHFFFAOYSA-N
XLogP2.00
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-propyl-1,2,4-oxadiazol-3-yl)propan-2-amine;hydrochloride
CID 47002453
2-(5-pentyl-1,2,4-oxadiazol-3-yl)propan-2-amine
CID 61326284
2-[5-(3,3-dimethylbutyl)-1,2,4-oxadiazol-3-yl]-1-methoxypropan-2-amine
CID 114212439
2-[5-(2,2-dimethylpropyl)-1,2,4-oxadiazol-3-yl]butan-2-amine
CID 61354500
2-(5-hexyl-1,2,4-oxadiazol-3-yl)propan-2-amine
CID 114753767
2-(5-heptyl-1,2,4-oxadiazol-3-yl)-1-methoxypropan-2-amine
CID 104636347
2-(5-butyl-1,2,4-oxadiazol-3-yl)-1-propan-2-yloxypropan-2-amine
CID 104637288
2-[5-(2-ethoxyethyl)-1,2,4-oxadiazol-3-yl]-1-methoxypropan-2-amine
CID 104636396
2-[5-[2-(furan-2-yl)ethyl]-1,2,4-oxadiazol-3-yl]butan-2-amine
CID 61324061
3-(5-heptyl-1,2,4-oxadiazol-3-yl)pentan-3-amine
CID 61325891
4-[3-(3-ethoxypentan-3-yl)-1,2,4-oxadiazol-5-yl]-2-methylbutan-2-amine
CID 116740998
1-methoxy-2-[5-(propoxymethyl)-1,2,4-oxadiazol-3-yl]propan-2-amine
CID 107940748

Frequently Asked Questions

What is the IUPAC name of 2-(5-propyl-1,2,4-oxadiazol-3-yl)pentan-2-amine?
The IUPAC name of 2-(5-propyl-1,2,4-oxadiazol-3-yl)pentan-2-amine (CID 43559532) is 2-(5-propyl-1,2,4-oxadiazol-3-yl)pentan-2-amine.
What is the SMILES notation for 2-(5-propyl-1,2,4-oxadiazol-3-yl)pentan-2-amine?
The canonical SMILES for 2-(5-propyl-1,2,4-oxadiazol-3-yl)pentan-2-amine is CCCc1nc(C(C)(N)CCC)no1.
What is the InChIKey of 2-(5-propyl-1,2,4-oxadiazol-3-yl)pentan-2-amine?
The InChIKey is FIGRYUVQJHCZEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-4-6-8-12-9(13-14-8)10(3,11)7-5-2/h4-7,11H2,1-3H3.
What are the key properties of 2-(5-propyl-1,2,4-oxadiazol-3-yl)pentan-2-amine?
2-(5-propyl-1,2,4-oxadiazol-3-yl)pentan-2-amine has a molecular weight of 197.28 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-propyl-1,2,4-oxadiazol-3-yl)pentan-2-amine is sourced from PubChem (CID 43559532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).