N-propyl-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-amine

C15H20N4O2 — CID 106474289

IUPACN-propyl-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-amine
SMILESCCCNC1CCOCC1c1nc(-c2ccccn2)no1
InChIInChI=1S/C15H20N4O2/c1-2-7-16-12-6-9-20-10-11(12)15-18-14(19-21-15)13-5-3-4-8-17-13/h3-5,8,11-12,16H,2,6-7,9-10H2,1H3
InChIKeyBFIJKFONCQCWHK-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.00
Rot. Bonds5

About N-propyl-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-amine

N-propyl-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-amine (PubChem CID 106474289) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is N-propyl-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-amine.

Molecular Properties

Compound NameN-propyl-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-amine
PubChem CID106474289
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC NameN-propyl-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-amine
SMILESCCCNC1CCOCC1c1nc(-c2ccccn2)no1
InChIInChI=1S/C15H20N4O2/c1-2-7-16-12-6-9-20-10-11(12)15-18-14(19-21-15)13-5-3-4-8-17-13/h3-5,8,11-12,16H,2,6-7,9-10H2,1H3
InChIKeyBFIJKFONCQCWHK-UHFFFAOYSA-N
XLogP2.00
TPSA73.07 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-propyl-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-amine
CID 106474293
N-ethyl-2-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)cyclopentan-1-amine
CID 55201646
4-[3-(4-methyl-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-propyloxolan-3-amine
CID 66252106
4-[3-(2-methylphenyl)-1,2,4-oxadiazol-5-yl]-N-propyloxolan-3-amine
CID 66253070
3-[3-(1-methylcyclopropyl)-1,2,4-oxadiazol-5-yl]-N-propyloxan-4-amine
CID 106474592
3-[3-(3-chloro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]-N-methyloxan-4-amine
CID 106474780
2-(3-phenyl-1,2,4-oxadiazol-5-yl)-N-propylcyclohexan-1-amine
CID 63348266
N-methyl-3-(3-phenyl-1,2,4-oxadiazol-5-yl)oxan-4-amine
CID 106474300
N-propyl-4-[3-(1H-pyrrol-2-yl)-1,2,4-oxadiazol-5-yl]oxolan-3-amine
CID 136984474
4-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]-N-propyloxolan-3-amine
CID 66251331
N-propyl-3-[3-(thiolan-2-yl)-1,2,4-oxadiazol-5-yl]oxan-4-amine
CID 106474605
5-(2-methylpyrrolidin-3-yl)-3-pyridin-2-yl-1,2,4-oxadiazole
CID 79371542

Frequently Asked Questions

What is the IUPAC name of N-propyl-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-amine?
The IUPAC name of N-propyl-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-amine (CID 106474289) is N-propyl-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-amine.
What is the SMILES notation for N-propyl-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-amine?
The canonical SMILES for N-propyl-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-amine is CCCNC1CCOCC1c1nc(-c2ccccn2)no1.
What is the InChIKey of N-propyl-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-amine?
The InChIKey is BFIJKFONCQCWHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c1-2-7-16-12-6-9-20-10-11(12)15-18-14(19-21-15)13-5-3-4-8-17-13/h3-5,8,11-12,16H,2,6-7,9-10H2,1H3.
What are the key properties of N-propyl-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-amine?
N-propyl-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-amine has a molecular weight of 288.35 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-3-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)oxan-4-amine is sourced from PubChem (CID 106474289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).