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

C11H20N4O2 — CID 107145151

IUPAC(1S)-1-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)pentan-1-amine
SMILESCCCC[C@H](N)c1nc(N2CCOCC2)no1
InChIInChI=1S/C11H20N4O2/c1-2-3-4-9(12)10-13-11(14-17-10)15-5-7-16-8-6-15/h9H,2-8,12H2,1H3/t9-/m0/s1
InChIKeyCKYZOOQGZVMJBJ-VIFPVBQESA-N
MW240.31 g/mol
LogP1.10
Rot. Bonds5

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

(1S)-1-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)pentan-1-amine (PubChem CID 107145151) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is (1S)-1-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)pentan-1-amine.

Molecular Properties

Compound Name(1S)-1-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)pentan-1-amine
PubChem CID107145151
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC Name(1S)-1-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)pentan-1-amine
SMILESCCCC[C@H](N)c1nc(N2CCOCC2)no1
InChIInChI=1S/C11H20N4O2/c1-2-3-4-9(12)10-13-11(14-17-10)15-5-7-16-8-6-15/h9H,2-8,12H2,1H3/t9-/m0/s1
InChIKeyCKYZOOQGZVMJBJ-VIFPVBQESA-N
XLogP1.10
TPSA77.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(1S)-1-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)propan-1-amine
CID 104915585
3-methylsulfonyl-1-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)propan-1-amine
CID 116807488
(1R)-1-(3-pyrrolidin-1-yl-1,2,4-oxadiazol-5-yl)butan-1-amine
CID 107565624
(1R)-1-(3-piperidin-1-yl-1,2,4-oxadiazol-5-yl)butan-1-amine
CID 107565626
(1R)-1-(3-piperidin-1-yl-1,2,4-oxadiazol-5-yl)propan-1-amine
CID 104915584
1-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)ethanol
CID 116808953
ethyl 3-methyl-2-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)butanoate
CID 116808604
4-[2-amino-2-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)ethyl]phenol
CID 116807586
(1S)-1-(3-methyl-1,2,4-oxadiazol-5-yl)pentan-1-amine
CID 93057386
(1S)-3-methylsulfanyl-1-(3-piperidin-1-yl-1,2,4-oxadiazol-5-yl)propan-1-amine
CID 104909677
1-(3-propan-2-yl-1,2,4-oxadiazol-5-yl)pentan-1-amine
CID 43470394
1-(3-propyl-1,2,4-oxadiazol-5-yl)pentan-1-amine
CID 43670431

Frequently Asked Questions

What is the IUPAC name of (1S)-1-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)pentan-1-amine?
The IUPAC name of (1S)-1-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)pentan-1-amine (CID 107145151) is (1S)-1-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)pentan-1-amine.
What is the SMILES notation for (1S)-1-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)pentan-1-amine?
The canonical SMILES for (1S)-1-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)pentan-1-amine is CCCC[C@H](N)c1nc(N2CCOCC2)no1.
What is the InChIKey of (1S)-1-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)pentan-1-amine?
The InChIKey is CKYZOOQGZVMJBJ-VIFPVBQESA-N. The full InChI is InChI=1S/C11H20N4O2/c1-2-3-4-9(12)10-13-11(14-17-10)15-5-7-16-8-6-15/h9H,2-8,12H2,1H3/t9-/m0/s1.
What are the key properties of (1S)-1-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)pentan-1-amine?
(1S)-1-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)pentan-1-amine has a molecular weight of 240.31 g/mol, XLogP of 1.10, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-(3-morpholin-4-yl-1,2,4-oxadiazol-5-yl)pentan-1-amine is sourced from PubChem (CID 107145151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).