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

C11H20N2O — CID 59843191

IUPACN,2-ditert-butyl-1,3-oxazol-5-amine
SMILESCC(C)(C)Nc1cnc(C(C)(C)C)o1
InChIInChI=1S/C11H20N2O/c1-10(2,3)9-12-7-8(14-9)13-11(4,5)6/h7,13H,1-6H3
InChIKeyPDUXBQFUHVDNLD-UHFFFAOYSA-N
MW196.29 g/mol
LogP3.18
Rot. Bonds1

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

N,2-ditert-butyl-1,3-oxazol-5-amine (PubChem CID 59843191) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is N,2-ditert-butyl-1,3-oxazol-5-amine.

Molecular Properties

Compound NameN,2-ditert-butyl-1,3-oxazol-5-amine
PubChem CID59843191
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC NameN,2-ditert-butyl-1,3-oxazol-5-amine
SMILESCC(C)(C)Nc1cnc(C(C)(C)C)o1
InChIInChI=1S/C11H20N2O/c1-10(2,3)9-12-7-8(14-9)13-11(4,5)6/h7,13H,1-6H3
InChIKeyPDUXBQFUHVDNLD-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,2-ditert-butyl-1,3-oxazol-5-amine?
The IUPAC name of N,2-ditert-butyl-1,3-oxazol-5-amine (CID 59843191) is N,2-ditert-butyl-1,3-oxazol-5-amine.
What is the SMILES notation for N,2-ditert-butyl-1,3-oxazol-5-amine?
The canonical SMILES for N,2-ditert-butyl-1,3-oxazol-5-amine is CC(C)(C)Nc1cnc(C(C)(C)C)o1.
What is the InChIKey of N,2-ditert-butyl-1,3-oxazol-5-amine?
The InChIKey is PDUXBQFUHVDNLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O/c1-10(2,3)9-12-7-8(14-9)13-11(4,5)6/h7,13H,1-6H3.
What are the key properties of N,2-ditert-butyl-1,3-oxazol-5-amine?
N,2-ditert-butyl-1,3-oxazol-5-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,2-ditert-butyl-1,3-oxazol-5-amine is sourced from PubChem (CID 59843191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).