3,5-dimethyl-N-(2-methyloxolan-3-yl)-1,2-oxazol-4-amine

C10H16N2O2 — CID 126989849

IUPAC3,5-dimethyl-N-(2-methyloxolan-3-yl)-1,2-oxazol-4-amine
SMILESCc1noc(C)c1NC1CCOC1C
InChIInChI=1S/C10H16N2O2/c1-6-10(8(3)14-12-6)11-9-4-5-13-7(9)2/h7,9,11H,4-5H2,1-3H3
InChIKeyWIAFACNKEDSHMX-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.88
Rot. Bonds2

About 3,5-dimethyl-N-(2-methyloxolan-3-yl)-1,2-oxazol-4-amine

3,5-dimethyl-N-(2-methyloxolan-3-yl)-1,2-oxazol-4-amine (PubChem CID 126989849) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is 3,5-dimethyl-N-(2-methyloxolan-3-yl)-1,2-oxazol-4-amine.

Molecular Properties

Compound Name3,5-dimethyl-N-(2-methyloxolan-3-yl)-1,2-oxazol-4-amine
PubChem CID126989849
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name3,5-dimethyl-N-(2-methyloxolan-3-yl)-1,2-oxazol-4-amine
SMILESCc1noc(C)c1NC1CCOC1C
InChIInChI=1S/C10H16N2O2/c1-6-10(8(3)14-12-6)11-9-4-5-13-7(9)2/h7,9,11H,4-5H2,1-3H3
InChIKeyWIAFACNKEDSHMX-UHFFFAOYSA-N
XLogP1.88
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-N-(2-methyloxolan-3-yl)-1,2-oxazol-4-amine?
The IUPAC name of 3,5-dimethyl-N-(2-methyloxolan-3-yl)-1,2-oxazol-4-amine (CID 126989849) is 3,5-dimethyl-N-(2-methyloxolan-3-yl)-1,2-oxazol-4-amine.
What is the SMILES notation for 3,5-dimethyl-N-(2-methyloxolan-3-yl)-1,2-oxazol-4-amine?
The canonical SMILES for 3,5-dimethyl-N-(2-methyloxolan-3-yl)-1,2-oxazol-4-amine is Cc1noc(C)c1NC1CCOC1C.
What is the InChIKey of 3,5-dimethyl-N-(2-methyloxolan-3-yl)-1,2-oxazol-4-amine?
The InChIKey is WIAFACNKEDSHMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O2/c1-6-10(8(3)14-12-6)11-9-4-5-13-7(9)2/h7,9,11H,4-5H2,1-3H3.
What are the key properties of 3,5-dimethyl-N-(2-methyloxolan-3-yl)-1,2-oxazol-4-amine?
3,5-dimethyl-N-(2-methyloxolan-3-yl)-1,2-oxazol-4-amine has a molecular weight of 196.25 g/mol, XLogP of 1.88, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-N-(2-methyloxolan-3-yl)-1,2-oxazol-4-amine is sourced from PubChem (CID 126989849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).