N,5-ditert-butyl-1,3-oxazol-2-amine

C11H20N2O — CID 59843208

IUPACN,5-ditert-butyl-1,3-oxazol-2-amine
SMILESCC(C)(C)Nc1ncc(C(C)(C)C)o1
InChIInChI=1S/C11H20N2O/c1-10(2,3)8-7-12-9(14-8)13-11(4,5)6/h7H,1-6H3,(H,12,13)
InChIKeyRAEWFDQHOZSBRQ-UHFFFAOYSA-N
MW196.29 g/mol
LogP3.18
Rot. Bonds1

About N,5-ditert-butyl-1,3-oxazol-2-amine

N,5-ditert-butyl-1,3-oxazol-2-amine (PubChem CID 59843208) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N,5-ditert-butyl-1,3-oxazol-2-amine.

Molecular Properties

Compound NameN,5-ditert-butyl-1,3-oxazol-2-amine
PubChem CID59843208
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN,5-ditert-butyl-1,3-oxazol-2-amine
SMILESCC(C)(C)Nc1ncc(C(C)(C)C)o1
InChIInChI=1S/C11H20N2O/c1-10(2,3)8-7-12-9(14-8)13-11(4,5)6/h7H,1-6H3,(H,12,13)
InChIKeyRAEWFDQHOZSBRQ-UHFFFAOYSA-N
XLogP3.18
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,5-ditert-butyl-1,3-oxazol-2-amine?
The IUPAC name of N,5-ditert-butyl-1,3-oxazol-2-amine (CID 59843208) is N,5-ditert-butyl-1,3-oxazol-2-amine.
What is the SMILES notation for N,5-ditert-butyl-1,3-oxazol-2-amine?
The canonical SMILES for N,5-ditert-butyl-1,3-oxazol-2-amine is CC(C)(C)Nc1ncc(C(C)(C)C)o1.
What is the InChIKey of N,5-ditert-butyl-1,3-oxazol-2-amine?
The InChIKey is RAEWFDQHOZSBRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-10(2,3)8-7-12-9(14-8)13-11(4,5)6/h7H,1-6H3,(H,12,13).
What are the key properties of N,5-ditert-butyl-1,3-oxazol-2-amine?
N,5-ditert-butyl-1,3-oxazol-2-amine has a molecular weight of 196.29 g/mol, XLogP of 3.18, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-ditert-butyl-1,3-oxazol-2-amine is sourced from PubChem (CID 59843208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).