1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-4-ethylcyclohexan-1-amine

C15H25N3O — CID 61295067

IUPAC1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-4-ethylcyclohexan-1-amine
SMILESCCC1CCC(N)(c2nc(C3CCCC3)no2)CC1
InChIInChI=1S/C15H25N3O/c1-2-11-7-9-15(16,10-8-11)14-17-13(18-19-14)12-5-3-4-6-12/h11-12H,2-10,16H2,1H3
InChIKeyRHDCLVVZFPEQHE-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.48
Rot. Bonds3

About 1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-4-ethylcyclohexan-1-amine

1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-4-ethylcyclohexan-1-amine (PubChem CID 61295067) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-4-ethylcyclohexan-1-amine.

Molecular Properties

Compound Name1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-4-ethylcyclohexan-1-amine
PubChem CID61295067
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-4-ethylcyclohexan-1-amine
SMILESCCC1CCC(N)(c2nc(C3CCCC3)no2)CC1
InChIInChI=1S/C15H25N3O/c1-2-11-7-9-15(16,10-8-11)14-17-13(18-19-14)12-5-3-4-6-12/h11-12H,2-10,16H2,1H3
InChIKeyRHDCLVVZFPEQHE-UHFFFAOYSA-N
XLogP3.48
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-4-ethylcyclohexan-1-amine?
The IUPAC name of 1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-4-ethylcyclohexan-1-amine (CID 61295067) is 1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-4-ethylcyclohexan-1-amine.
What is the SMILES notation for 1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-4-ethylcyclohexan-1-amine?
The canonical SMILES for 1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-4-ethylcyclohexan-1-amine is CCC1CCC(N)(c2nc(C3CCCC3)no2)CC1.
What is the InChIKey of 1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-4-ethylcyclohexan-1-amine?
The InChIKey is RHDCLVVZFPEQHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-2-11-7-9-15(16,10-8-11)14-17-13(18-19-14)12-5-3-4-6-12/h11-12H,2-10,16H2,1H3.
What are the key properties of 1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-4-ethylcyclohexan-1-amine?
1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-4-ethylcyclohexan-1-amine has a molecular weight of 263.38 g/mol, XLogP of 3.48, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-4-ethylcyclohexan-1-amine is sourced from PubChem (CID 61295067), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).