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

C10H19N3O — CID 43670431

IUPAC1-(3-propyl-1,2,4-oxadiazol-5-yl)pentan-1-amine
SMILESCCCCC(N)c1nc(CCC)no1
InChIInChI=1S/C10H19N3O/c1-3-5-7-8(11)10-12-9(6-4-2)13-14-10/h8H,3-7,11H2,1-2H3
InChIKeyPRGAFHOJBFHKTF-UHFFFAOYSA-N
MW197.28 g/mol
LogP2.21
Rot. Bonds6

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

1-(3-propyl-1,2,4-oxadiazol-5-yl)pentan-1-amine (PubChem CID 43670431) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 1-(3-propyl-1,2,4-oxadiazol-5-yl)pentan-1-amine.

Molecular Properties

Compound Name1-(3-propyl-1,2,4-oxadiazol-5-yl)pentan-1-amine
PubChem CID43670431
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name1-(3-propyl-1,2,4-oxadiazol-5-yl)pentan-1-amine
SMILESCCCCC(N)c1nc(CCC)no1
InChIInChI=1S/C10H19N3O/c1-3-5-7-8(11)10-12-9(6-4-2)13-14-10/h8H,3-7,11H2,1-2H3
InChIKeyPRGAFHOJBFHKTF-UHFFFAOYSA-N
XLogP2.21
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-propyl-1,2,4-oxadiazol-5-yl)butan-1-amine
CID 43670386
1-[3-[2-(dimethylamino)ethyl]-1,2,4-oxadiazol-5-yl]pentan-1-amine
CID 115345285
3-methylsulfanyl-1-(3-propyl-1,2,4-oxadiazol-5-yl)propan-1-amine
CID 43670404
(1S)-1-[3-(2-methoxypropyl)-1,2,4-oxadiazol-5-yl]pentan-1-amine
CID 107145098
(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)pentan-1-amine
CID 93057386
(1S)-1-[3-(tert-butylsulfanylmethyl)-1,2,4-oxadiazol-5-yl]pentan-1-amine
CID 107144978
1-(3-butyl-1,2,4-oxadiazol-5-yl)-3-methylsulfanylpropan-1-amine
CID 79405955
1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pentan-1-amine
CID 43470394
1-[3-[2-(2,2,2-trifluoroethoxy)ethyl]-1,2,4-oxadiazol-5-yl]pentan-1-amine
CID 103145887
1-[3-(2-phenoxyethyl)-1,2,4-oxadiazol-5-yl]pentan-1-amine
CID 43470343
1-(3-propyl-1,2,4-oxadiazol-5-yl)ethanamine
CID 43670441
2-[5-[(1S)-1-aminobutyl]-1,2,4-oxadiazol-3-yl]ethanol
CID 107565558

Frequently Asked Questions

What is the IUPAC name of 1-(3-propyl-1,2,4-oxadiazol-5-yl)pentan-1-amine?
The IUPAC name of 1-(3-propyl-1,2,4-oxadiazol-5-yl)pentan-1-amine (CID 43670431) is 1-(3-propyl-1,2,4-oxadiazol-5-yl)pentan-1-amine.
What is the SMILES notation for 1-(3-propyl-1,2,4-oxadiazol-5-yl)pentan-1-amine?
The canonical SMILES for 1-(3-propyl-1,2,4-oxadiazol-5-yl)pentan-1-amine is CCCCC(N)c1nc(CCC)no1.
What is the InChIKey of 1-(3-propyl-1,2,4-oxadiazol-5-yl)pentan-1-amine?
The InChIKey is PRGAFHOJBFHKTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-3-5-7-8(11)10-12-9(6-4-2)13-14-10/h8H,3-7,11H2,1-2H3.
What are the key properties of 1-(3-propyl-1,2,4-oxadiazol-5-yl)pentan-1-amine?
1-(3-propyl-1,2,4-oxadiazol-5-yl)pentan-1-amine has a molecular weight of 197.28 g/mol, XLogP of 2.21, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-propyl-1,2,4-oxadiazol-5-yl)pentan-1-amine is sourced from PubChem (CID 43670431), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).