3-cyclohexyl-1,2-oxazol-5-amine

C9H14N2O — CID 13377311

IUPAC3-cyclohexyl-1,2-oxazol-5-amine
SMILESNc1cc(C2CCCCC2)no1
InChIInChI=1S/C9H14N2O/c10-9-6-8(11-12-9)7-4-2-1-3-5-7/h6-7H,1-5,10H2
InChIKeyVQZCMFOELVYEHV-UHFFFAOYSA-N
MW166.22 g/mol
LogP2.30
Rot. Bonds1

About 3-cyclohexyl-1,2-oxazol-5-amine

3-cyclohexyl-1,2-oxazol-5-amine (PubChem CID 13377311) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 3-cyclohexyl-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-cyclohexyl-1,2-oxazol-5-amine
PubChem CID13377311
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name3-cyclohexyl-1,2-oxazol-5-amine
SMILESNc1cc(C2CCCCC2)no1
InChIInChI=1S/C9H14N2O/c10-9-6-8(11-12-9)7-4-2-1-3-5-7/h6-7H,1-5,10H2
InChIKeyVQZCMFOELVYEHV-UHFFFAOYSA-N
XLogP2.30
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexyl-1,2-oxazol-5-amine?
The IUPAC name of 3-cyclohexyl-1,2-oxazol-5-amine (CID 13377311) is 3-cyclohexyl-1,2-oxazol-5-amine.
What is the SMILES notation for 3-cyclohexyl-1,2-oxazol-5-amine?
The canonical SMILES for 3-cyclohexyl-1,2-oxazol-5-amine is Nc1cc(C2CCCCC2)no1.
What is the InChIKey of 3-cyclohexyl-1,2-oxazol-5-amine?
The InChIKey is VQZCMFOELVYEHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c10-9-6-8(11-12-9)7-4-2-1-3-5-7/h6-7H,1-5,10H2.
What are the key properties of 3-cyclohexyl-1,2-oxazol-5-amine?
3-cyclohexyl-1,2-oxazol-5-amine has a molecular weight of 166.22 g/mol, XLogP of 2.30, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexyl-1,2-oxazol-5-amine is sourced from PubChem (CID 13377311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).