5-methyl-2-propan-2-yl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)cyclohexan-1-amine

C15H27N3O — CID 43559620

IUPAC5-methyl-2-propan-2-yl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)cyclohexan-1-amine
SMILESCC1CCC(C(C)C)C(N)(c2noc(C(C)C)n2)C1
InChIInChI=1S/C15H27N3O/c1-9(2)12-7-6-11(5)8-15(12,16)14-17-13(10(3)4)19-18-14/h9-12H,6-8,16H2,1-5H3
InChIKeyJXLQUZHMARDSAC-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.44
Rot. Bonds3

About 5-methyl-2-propan-2-yl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)cyclohexan-1-amine

5-methyl-2-propan-2-yl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)cyclohexan-1-amine (PubChem CID 43559620) has the molecular formula C15H27N3O and a molecular weight of 265.40 g/mol. Its IUPAC name is 5-methyl-2-propan-2-yl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)cyclohexan-1-amine.

Molecular Properties

Compound Name5-methyl-2-propan-2-yl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)cyclohexan-1-amine
PubChem CID43559620
Molecular FormulaC15H27N3O
Molecular Weight265.40 g/mol
Exact Mass265.22
IUPAC Name5-methyl-2-propan-2-yl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)cyclohexan-1-amine
SMILESCC1CCC(C(C)C)C(N)(c2noc(C(C)C)n2)C1
InChIInChI=1S/C15H27N3O/c1-9(2)12-7-6-11(5)8-15(12,16)14-17-13(10(3)4)19-18-14/h9-12H,6-8,16H2,1-5H3
InChIKeyJXLQUZHMARDSAC-UHFFFAOYSA-N
XLogP3.44
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-propan-2-yl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)cyclohexan-1-amine?
The IUPAC name of 5-methyl-2-propan-2-yl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)cyclohexan-1-amine (CID 43559620) is 5-methyl-2-propan-2-yl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)cyclohexan-1-amine.
What is the SMILES notation for 5-methyl-2-propan-2-yl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)cyclohexan-1-amine?
The canonical SMILES for 5-methyl-2-propan-2-yl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)cyclohexan-1-amine is CC1CCC(C(C)C)C(N)(c2noc(C(C)C)n2)C1.
What is the InChIKey of 5-methyl-2-propan-2-yl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)cyclohexan-1-amine?
The InChIKey is JXLQUZHMARDSAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O/c1-9(2)12-7-6-11(5)8-15(12,16)14-17-13(10(3)4)19-18-14/h9-12H,6-8,16H2,1-5H3.
What are the key properties of 5-methyl-2-propan-2-yl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)cyclohexan-1-amine?
5-methyl-2-propan-2-yl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)cyclohexan-1-amine has a molecular weight of 265.40 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-propan-2-yl-1-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)cyclohexan-1-amine is sourced from PubChem (CID 43559620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).