2-ethyl-N-(2-methylbutan-2-yl)-1,3-oxazol-5-amine

C10H18N2O — CID 89100615

IUPAC2-ethyl-N-(2-methylbutan-2-yl)-1,3-oxazol-5-amine
SMILESCCc1ncc(NC(C)(C)CC)o1
InChIInChI=1S/C10H18N2O/c1-5-8-11-7-9(13-8)12-10(3,4)6-2/h7,12H,5-6H2,1-4H3
InChIKeyPENDYRDNIQGAJU-UHFFFAOYSA-N
MW182.27 g/mol
LogP2.84
Rot. Bonds4

About 2-ethyl-N-(2-methylbutan-2-yl)-1,3-oxazol-5-amine

2-ethyl-N-(2-methylbutan-2-yl)-1,3-oxazol-5-amine (PubChem CID 89100615) has the molecular formula C10H18N2O and a molecular weight of 182.27 g/mol. Its IUPAC name is 2-ethyl-N-(2-methylbutan-2-yl)-1,3-oxazol-5-amine.

Molecular Properties

Compound Name2-ethyl-N-(2-methylbutan-2-yl)-1,3-oxazol-5-amine
PubChem CID89100615
Molecular FormulaC10H18N2O
Molecular Weight182.27 g/mol
Exact Mass182.14
IUPAC Name2-ethyl-N-(2-methylbutan-2-yl)-1,3-oxazol-5-amine
SMILESCCc1ncc(NC(C)(C)CC)o1
InChIInChI=1S/C10H18N2O/c1-5-8-11-7-9(13-8)12-10(3,4)6-2/h7,12H,5-6H2,1-4H3
InChIKeyPENDYRDNIQGAJU-UHFFFAOYSA-N
XLogP2.84
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.27
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-N-(2-methylbutan-2-yl)-1,3-oxazol-5-amine?
The IUPAC name of 2-ethyl-N-(2-methylbutan-2-yl)-1,3-oxazol-5-amine (CID 89100615) is 2-ethyl-N-(2-methylbutan-2-yl)-1,3-oxazol-5-amine.
What is the SMILES notation for 2-ethyl-N-(2-methylbutan-2-yl)-1,3-oxazol-5-amine?
The canonical SMILES for 2-ethyl-N-(2-methylbutan-2-yl)-1,3-oxazol-5-amine is CCc1ncc(NC(C)(C)CC)o1.
What is the InChIKey of 2-ethyl-N-(2-methylbutan-2-yl)-1,3-oxazol-5-amine?
The InChIKey is PENDYRDNIQGAJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O/c1-5-8-11-7-9(13-8)12-10(3,4)6-2/h7,12H,5-6H2,1-4H3.
What are the key properties of 2-ethyl-N-(2-methylbutan-2-yl)-1,3-oxazol-5-amine?
2-ethyl-N-(2-methylbutan-2-yl)-1,3-oxazol-5-amine has a molecular weight of 182.27 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-N-(2-methylbutan-2-yl)-1,3-oxazol-5-amine is sourced from PubChem (CID 89100615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).