2-(2-cyclohexyl-1,3-oxazol-5-yl)propan-1-amine

C12H20N2O — CID 115087448

IUPAC2-(2-cyclohexyl-1,3-oxazol-5-yl)propan-1-amine
SMILESCC(CN)c1cnc(C2CCCCC2)o1
InChIInChI=1S/C12H20N2O/c1-9(7-13)11-8-14-12(15-11)10-5-3-2-4-6-10/h8-10H,2-7,13H2,1H3
InChIKeyUPCQRVNZLXWETR-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.78
Rot. Bonds3

About 2-(2-cyclohexyl-1,3-oxazol-5-yl)propan-1-amine

2-(2-cyclohexyl-1,3-oxazol-5-yl)propan-1-amine (PubChem CID 115087448) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is 2-(2-cyclohexyl-1,3-oxazol-5-yl)propan-1-amine.

Molecular Properties

Compound Name2-(2-cyclohexyl-1,3-oxazol-5-yl)propan-1-amine
PubChem CID115087448
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name2-(2-cyclohexyl-1,3-oxazol-5-yl)propan-1-amine
SMILESCC(CN)c1cnc(C2CCCCC2)o1
InChIInChI=1S/C12H20N2O/c1-9(7-13)11-8-14-12(15-11)10-5-3-2-4-6-10/h8-10H,2-7,13H2,1H3
InChIKeyUPCQRVNZLXWETR-UHFFFAOYSA-N
XLogP2.78
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclohexyl-1,3-oxazol-5-yl)propan-1-amine?
The IUPAC name of 2-(2-cyclohexyl-1,3-oxazol-5-yl)propan-1-amine (CID 115087448) is 2-(2-cyclohexyl-1,3-oxazol-5-yl)propan-1-amine.
What is the SMILES notation for 2-(2-cyclohexyl-1,3-oxazol-5-yl)propan-1-amine?
The canonical SMILES for 2-(2-cyclohexyl-1,3-oxazol-5-yl)propan-1-amine is CC(CN)c1cnc(C2CCCCC2)o1.
What is the InChIKey of 2-(2-cyclohexyl-1,3-oxazol-5-yl)propan-1-amine?
The InChIKey is UPCQRVNZLXWETR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-9(7-13)11-8-14-12(15-11)10-5-3-2-4-6-10/h8-10H,2-7,13H2,1H3.
What are the key properties of 2-(2-cyclohexyl-1,3-oxazol-5-yl)propan-1-amine?
2-(2-cyclohexyl-1,3-oxazol-5-yl)propan-1-amine has a molecular weight of 208.30 g/mol, XLogP of 2.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclohexyl-1,3-oxazol-5-yl)propan-1-amine is sourced from PubChem (CID 115087448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).