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

C15H25N3O — CID 43559738

IUPAC1-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-methyl-2-propan-2-ylcyclohexan-1-amine
SMILESCC1CCC(C(C)C)C(N)(c2noc(C3CC3)n2)C1
InChIInChI=1S/C15H25N3O/c1-9(2)12-7-4-10(3)8-15(12,16)14-17-13(19-18-14)11-5-6-11/h9-12H,4-8,16H2,1-3H3
InChIKeySKVDCJXYBAIKFA-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.19
Rot. Bonds3

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

1-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-methyl-2-propan-2-ylcyclohexan-1-amine (PubChem CID 43559738) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is 1-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-methyl-2-propan-2-ylcyclohexan-1-amine.

Molecular Properties

Compound Name1-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-methyl-2-propan-2-ylcyclohexan-1-amine
PubChem CID43559738
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC Name1-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-methyl-2-propan-2-ylcyclohexan-1-amine
SMILESCC1CCC(C(C)C)C(N)(c2noc(C3CC3)n2)C1
InChIInChI=1S/C15H25N3O/c1-9(2)12-7-4-10(3)8-15(12,16)14-17-13(19-18-14)11-5-6-11/h9-12H,4-8,16H2,1-3H3
InChIKeySKVDCJXYBAIKFA-UHFFFAOYSA-N
XLogP3.19
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 ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-methyl-2-propan-2-ylcyclohexan-1-amine?
The IUPAC name of 1-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-methyl-2-propan-2-ylcyclohexan-1-amine (CID 43559738) is 1-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-methyl-2-propan-2-ylcyclohexan-1-amine.
What is the SMILES notation for 1-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-methyl-2-propan-2-ylcyclohexan-1-amine?
The canonical SMILES for 1-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-methyl-2-propan-2-ylcyclohexan-1-amine is CC1CCC(C(C)C)C(N)(c2noc(C3CC3)n2)C1.
What is the InChIKey of 1-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-methyl-2-propan-2-ylcyclohexan-1-amine?
The InChIKey is SKVDCJXYBAIKFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-9(2)12-7-4-10(3)8-15(12,16)14-17-13(19-18-14)11-5-6-11/h9-12H,4-8,16H2,1-3H3.
What are the key properties of 1-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-methyl-2-propan-2-ylcyclohexan-1-amine?
1-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-methyl-2-propan-2-ylcyclohexan-1-amine has a molecular weight of 263.38 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyclopropyl-1,2,4-oxadiazol-3-yl)-5-methyl-2-propan-2-ylcyclohexan-1-amine is sourced from PubChem (CID 43559738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).