4-(3-cyclopentylphenyl)-1,2-oxazol-5-amine

C14H16N2O — CID 117329061

IUPAC4-(3-cyclopentylphenyl)-1,2-oxazol-5-amine
SMILESNc1oncc1-c1cccc(C2CCCC2)c1
InChIInChI=1S/C14H16N2O/c15-14-13(9-16-17-14)12-7-3-6-11(8-12)10-4-1-2-5-10/h3,6-10H,1-2,4-5,15H2
InChIKeyIMRZWHNEZUCAFF-UHFFFAOYSA-N
MW228.30 g/mol
LogP3.58
Rot. Bonds2

About 4-(3-cyclopentylphenyl)-1,2-oxazol-5-amine

4-(3-cyclopentylphenyl)-1,2-oxazol-5-amine (PubChem CID 117329061) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is 4-(3-cyclopentylphenyl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name4-(3-cyclopentylphenyl)-1,2-oxazol-5-amine
PubChem CID117329061
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name4-(3-cyclopentylphenyl)-1,2-oxazol-5-amine
SMILESNc1oncc1-c1cccc(C2CCCC2)c1
InChIInChI=1S/C14H16N2O/c15-14-13(9-16-17-14)12-7-3-6-11(8-12)10-4-1-2-5-10/h3,6-10H,1-2,4-5,15H2
InChIKeyIMRZWHNEZUCAFF-UHFFFAOYSA-N
XLogP3.58
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3-cyclopentylphenyl)-1,2-oxazol-5-amine?
The IUPAC name of 4-(3-cyclopentylphenyl)-1,2-oxazol-5-amine (CID 117329061) is 4-(3-cyclopentylphenyl)-1,2-oxazol-5-amine.
What is the SMILES notation for 4-(3-cyclopentylphenyl)-1,2-oxazol-5-amine?
The canonical SMILES for 4-(3-cyclopentylphenyl)-1,2-oxazol-5-amine is Nc1oncc1-c1cccc(C2CCCC2)c1.
What is the InChIKey of 4-(3-cyclopentylphenyl)-1,2-oxazol-5-amine?
The InChIKey is IMRZWHNEZUCAFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c15-14-13(9-16-17-14)12-7-3-6-11(8-12)10-4-1-2-5-10/h3,6-10H,1-2,4-5,15H2.
What are the key properties of 4-(3-cyclopentylphenyl)-1,2-oxazol-5-amine?
4-(3-cyclopentylphenyl)-1,2-oxazol-5-amine has a molecular weight of 228.30 g/mol, XLogP of 3.58, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-cyclopentylphenyl)-1,2-oxazol-5-amine is sourced from PubChem (CID 117329061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).