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

C10H16N2O — CID 60683537

IUPACN-(1,2-oxazol-5-ylmethyl)cyclohexanamine
SMILESc1cc(CNC2CCCCC2)on1
InChIInChI=1S/C10H16N2O/c1-2-4-9(5-3-1)11-8-10-6-7-12-13-10/h6-7,9,11H,1-5,8H2
InChIKeyUADJHKVAIHXGSO-UHFFFAOYSA-N
MW180.25 g/mol
LogP2.10
Rot. Bonds3

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

N-(1,2-oxazol-5-ylmethyl)cyclohexanamine (PubChem CID 60683537) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is N-(1,2-oxazol-5-ylmethyl)cyclohexanamine.

Molecular Properties

Compound NameN-(1,2-oxazol-5-ylmethyl)cyclohexanamine
PubChem CID60683537
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC NameN-(1,2-oxazol-5-ylmethyl)cyclohexanamine
SMILESc1cc(CNC2CCCCC2)on1
InChIInChI=1S/C10H16N2O/c1-2-4-9(5-3-1)11-8-10-6-7-12-13-10/h6-7,9,11H,1-5,8H2
InChIKeyUADJHKVAIHXGSO-UHFFFAOYSA-N
XLogP2.10
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 52.10
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)cyclohexanamine?
The IUPAC name of N-(1,2-oxazol-5-ylmethyl)cyclohexanamine (CID 60683537) is N-(1,2-oxazol-5-ylmethyl)cyclohexanamine.
What is the SMILES notation for N-(1,2-oxazol-5-ylmethyl)cyclohexanamine?
The canonical SMILES for N-(1,2-oxazol-5-ylmethyl)cyclohexanamine is c1cc(CNC2CCCCC2)on1.
What is the InChIKey of N-(1,2-oxazol-5-ylmethyl)cyclohexanamine?
The InChIKey is UADJHKVAIHXGSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-2-4-9(5-3-1)11-8-10-6-7-12-13-10/h6-7,9,11H,1-5,8H2.
What are the key properties of N-(1,2-oxazol-5-ylmethyl)cyclohexanamine?
N-(1,2-oxazol-5-ylmethyl)cyclohexanamine has a molecular weight of 180.25 g/mol, XLogP of 2.10, 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)cyclohexanamine is sourced from PubChem (CID 60683537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).