cyclopentyl-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine

C11H19N3O — CID 62070741

IUPACcyclopentyl-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine
SMILESCC(C)c1nc(C(N)C2CCCC2)no1
InChIInChI=1S/C11H19N3O/c1-7(2)11-13-10(14-15-11)9(12)8-5-3-4-6-8/h7-9H,3-6,12H2,1-2H3
InChIKeyVVGFRMOKRJDVSP-UHFFFAOYSA-N
MW209.29 g/mol
LogP2.38
Rot. Bonds3

About cyclopentyl-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine

cyclopentyl-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine (PubChem CID 62070741) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is cyclopentyl-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine.

Molecular Properties

Compound Namecyclopentyl-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine
PubChem CID62070741
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Namecyclopentyl-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine
SMILESCC(C)c1nc(C(N)C2CCCC2)no1
InChIInChI=1S/C11H19N3O/c1-7(2)11-13-10(14-15-11)9(12)8-5-3-4-6-8/h7-9H,3-6,12H2,1-2H3
InChIKeyVVGFRMOKRJDVSP-UHFFFAOYSA-N
XLogP2.38
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of cyclopentyl-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine?
The IUPAC name of cyclopentyl-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine (CID 62070741) is cyclopentyl-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine.
What is the SMILES notation for cyclopentyl-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine?
The canonical SMILES for cyclopentyl-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine is CC(C)c1nc(C(N)C2CCCC2)no1.
What is the InChIKey of cyclopentyl-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine?
The InChIKey is VVGFRMOKRJDVSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-7(2)11-13-10(14-15-11)9(12)8-5-3-4-6-8/h7-9H,3-6,12H2,1-2H3.
What are the key properties of cyclopentyl-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine?
cyclopentyl-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine has a molecular weight of 209.29 g/mol, XLogP of 2.38, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopentyl-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)methanamine is sourced from PubChem (CID 62070741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).