N-(1,2-oxazol-5-ylmethyl)cyclopentanamine

C9H14N2O — CID 60687089

IUPACN-(1,2-oxazol-5-ylmethyl)cyclopentanamine
SMILESc1cc(CNC2CCCC2)on1
InChIInChI=1S/C9H14N2O/c1-2-4-8(3-1)10-7-9-5-6-11-12-9/h5-6,8,10H,1-4,7H2
InChIKeyYAXAVTGMIPJCNR-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.71
Rot. Bonds3

About N-(1,2-oxazol-5-ylmethyl)cyclopentanamine

N-(1,2-oxazol-5-ylmethyl)cyclopentanamine (PubChem CID 60687089) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is N-(1,2-oxazol-5-ylmethyl)cyclopentanamine.

Molecular Properties

Compound NameN-(1,2-oxazol-5-ylmethyl)cyclopentanamine
PubChem CID60687089
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC NameN-(1,2-oxazol-5-ylmethyl)cyclopentanamine
SMILESc1cc(CNC2CCCC2)on1
InChIInChI=1S/C9H14N2O/c1-2-4-8(3-1)10-7-9-5-6-11-12-9/h5-6,8,10H,1-4,7H2
InChIKeyYAXAVTGMIPJCNR-UHFFFAOYSA-N
XLogP1.71
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1,2-oxazol-5-ylmethyl)cyclopentanamine?
The IUPAC name of N-(1,2-oxazol-5-ylmethyl)cyclopentanamine (CID 60687089) is N-(1,2-oxazol-5-ylmethyl)cyclopentanamine.
What is the SMILES notation for N-(1,2-oxazol-5-ylmethyl)cyclopentanamine?
The canonical SMILES for N-(1,2-oxazol-5-ylmethyl)cyclopentanamine is c1cc(CNC2CCCC2)on1.
What is the InChIKey of N-(1,2-oxazol-5-ylmethyl)cyclopentanamine?
The InChIKey is YAXAVTGMIPJCNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-2-4-8(3-1)10-7-9-5-6-11-12-9/h5-6,8,10H,1-4,7H2.
What are the key properties of N-(1,2-oxazol-5-ylmethyl)cyclopentanamine?
N-(1,2-oxazol-5-ylmethyl)cyclopentanamine has a molecular weight of 166.22 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-oxazol-5-ylmethyl)cyclopentanamine is sourced from PubChem (CID 60687089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).