1-(5-cyclohexyl-1,3-oxazol-2-yl)-N-ethylethanamine

C13H22N2O — CID 65181292

IUPAC1-(5-cyclohexyl-1,3-oxazol-2-yl)-N-ethylethanamine
SMILESCCNC(C)c1ncc(C2CCCCC2)o1
InChIInChI=1S/C13H22N2O/c1-3-14-10(2)13-15-9-12(16-13)11-7-5-4-6-8-11/h9-11,14H,3-8H2,1-2H3
InChIKeyCBGCALAQYPLMQH-UHFFFAOYSA-N
MW222.33 g/mol
LogP3.39
Rot. Bonds4

About 1-(5-cyclohexyl-1,3-oxazol-2-yl)-N-ethylethanamine

1-(5-cyclohexyl-1,3-oxazol-2-yl)-N-ethylethanamine (PubChem CID 65181292) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is 1-(5-cyclohexyl-1,3-oxazol-2-yl)-N-ethylethanamine.

Molecular Properties

Compound Name1-(5-cyclohexyl-1,3-oxazol-2-yl)-N-ethylethanamine
PubChem CID65181292
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC Name1-(5-cyclohexyl-1,3-oxazol-2-yl)-N-ethylethanamine
SMILESCCNC(C)c1ncc(C2CCCCC2)o1
InChIInChI=1S/C13H22N2O/c1-3-14-10(2)13-15-9-12(16-13)11-7-5-4-6-8-11/h9-11,14H,3-8H2,1-2H3
InChIKeyCBGCALAQYPLMQH-UHFFFAOYSA-N
XLogP3.39
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-cyclohexyl-1,3-oxazol-2-yl)-N-ethylethanamine?
The IUPAC name of 1-(5-cyclohexyl-1,3-oxazol-2-yl)-N-ethylethanamine (CID 65181292) is 1-(5-cyclohexyl-1,3-oxazol-2-yl)-N-ethylethanamine.
What is the SMILES notation for 1-(5-cyclohexyl-1,3-oxazol-2-yl)-N-ethylethanamine?
The canonical SMILES for 1-(5-cyclohexyl-1,3-oxazol-2-yl)-N-ethylethanamine is CCNC(C)c1ncc(C2CCCCC2)o1.
What is the InChIKey of 1-(5-cyclohexyl-1,3-oxazol-2-yl)-N-ethylethanamine?
The InChIKey is CBGCALAQYPLMQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-3-14-10(2)13-15-9-12(16-13)11-7-5-4-6-8-11/h9-11,14H,3-8H2,1-2H3.
What are the key properties of 1-(5-cyclohexyl-1,3-oxazol-2-yl)-N-ethylethanamine?
1-(5-cyclohexyl-1,3-oxazol-2-yl)-N-ethylethanamine has a molecular weight of 222.33 g/mol, XLogP of 3.39, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyclohexyl-1,3-oxazol-2-yl)-N-ethylethanamine is sourced from PubChem (CID 65181292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).