N-tert-butyl-2-(tert-butylamino)-1,3-oxazole-5-carboxamide

C12H21N3O2 — CID 122693179

IUPACN-tert-butyl-2-(tert-butylamino)-1,3-oxazole-5-carboxamide
SMILESCC(C)(C)NC(=O)c1cnc(NC(C)(C)C)o1
InChIInChI=1S/C12H21N3O2/c1-11(2,3)14-9(16)8-7-13-10(17-8)15-12(4,5)6/h7H,1-6H3,(H,13,15)(H,14,16)
InChIKeyGNQPXDIXNUEIHO-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.41
Rot. Bonds2

About N-tert-butyl-2-(tert-butylamino)-1,3-oxazole-5-carboxamide

N-tert-butyl-2-(tert-butylamino)-1,3-oxazole-5-carboxamide (PubChem CID 122693179) has the molecular formula C12H21N3O2 and a molecular weight of 239.32 g/mol. Its IUPAC name is N-tert-butyl-2-(tert-butylamino)-1,3-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-tert-butyl-2-(tert-butylamino)-1,3-oxazole-5-carboxamide
PubChem CID122693179
Molecular FormulaC12H21N3O2
Molecular Weight239.32 g/mol
Exact Mass239.16
IUPAC NameN-tert-butyl-2-(tert-butylamino)-1,3-oxazole-5-carboxamide
SMILESCC(C)(C)NC(=O)c1cnc(NC(C)(C)C)o1
InChIInChI=1S/C12H21N3O2/c1-11(2,3)14-9(16)8-7-13-10(17-8)15-12(4,5)6/h7H,1-6H3,(H,13,15)(H,14,16)
InChIKeyGNQPXDIXNUEIHO-UHFFFAOYSA-N
XLogP2.41
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-(methylamino)-1,3-oxazole-5-carboxamide
CID 122695718
N-tert-butyl-5-(tert-butylamino)-1H-imidazole-2-carboxamide
CID 122693161
N-tert-butyl-5-phenyl-1,3-oxazol-2-amine
CID 12707556
N-tert-butyl-3-hydrazinyl-1H-pyrazole-5-carboxamide
CID 123341338
N-tert-butyl-1-benzofuran-2-carboxamide
CID 737735
1-N,2-N,4-N,5-N-tetratert-butylbenzene-1,2,4,5-tetracarboxamide
CID 141420303
3-N,6-N-ditert-butylpyridazine-3,6-dicarboxamide
CID 139234600
5-(tert-butylcarbamoyl)-2-methylfuran-3-sulfonyl chloride
CID 65372173
5-amino-N-tert-butyl-1-benzofuran-2-carboxamide
CID 61092383
N-tert-butyl-3-[2-(methylamino)-1,3-oxazol-5-yl]benzamide;propane
CID 144513424
5-(4-bromophenyl)-N-tert-butylfuran-2-carboxamide
CID 1370910
N-tert-butyl-5-butylfuran-2-carboxamide
CID 70989839

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(tert-butylamino)-1,3-oxazole-5-carboxamide?
The IUPAC name of N-tert-butyl-2-(tert-butylamino)-1,3-oxazole-5-carboxamide (CID 122693179) is N-tert-butyl-2-(tert-butylamino)-1,3-oxazole-5-carboxamide.
What is the SMILES notation for N-tert-butyl-2-(tert-butylamino)-1,3-oxazole-5-carboxamide?
The canonical SMILES for N-tert-butyl-2-(tert-butylamino)-1,3-oxazole-5-carboxamide is CC(C)(C)NC(=O)c1cnc(NC(C)(C)C)o1.
What is the InChIKey of N-tert-butyl-2-(tert-butylamino)-1,3-oxazole-5-carboxamide?
The InChIKey is GNQPXDIXNUEIHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3O2/c1-11(2,3)14-9(16)8-7-13-10(17-8)15-12(4,5)6/h7H,1-6H3,(H,13,15)(H,14,16).
What are the key properties of N-tert-butyl-2-(tert-butylamino)-1,3-oxazole-5-carboxamide?
N-tert-butyl-2-(tert-butylamino)-1,3-oxazole-5-carboxamide has a molecular weight of 239.32 g/mol, XLogP of 2.41, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(tert-butylamino)-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 122693179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).