N-Ethyl-3-methyl-1,2-oxazol-5-amine

C6H10N2O — CID 12446345

IUPACN-ethyl-3-methyl-1,2-oxazol-5-amine
SMILESCCNC1=CC(=NO1)C
InChIInChI=1S/C6H10N2O/c1-3-7-6-4-5(2)8-9-6/h4,7H,3H2,1-2H3
InChIKeyGVONDJIPXGUCHI-UHFFFAOYSA-N
MW126.16 g/mol
LogP1.50
Rot. Bonds2

About N-Ethyl-3-methyl-1,2-oxazol-5-amine

N-Ethyl-3-methyl-1,2-oxazol-5-amine (PubChem CID 12446345) has the molecular formula C6H10N2O and a molecular weight of 126.16 g/mol. Its IUPAC name is N-ethyl-3-methyl-1,2-oxazol-5-amine.

Molecular Properties

Compound NameN-Ethyl-3-methyl-1,2-oxazol-5-amine
PubChem CID12446345
Molecular FormulaC6H10N2O
Molecular Weight126.16 g/mol
Exact Mass126.08
IUPAC NameN-ethyl-3-methyl-1,2-oxazol-5-amine
SMILESCCNC1=CC(=NO1)C
InChIInChI=1S/C6H10N2O/c1-3-7-6-4-5(2)8-9-6/h4,7H,3H2,1-2H3
InChIKeyGVONDJIPXGUCHI-UHFFFAOYSA-N
XLogP1.50
TPSA38.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity87

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.16
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-Ethyl-3-methyl-1,2-oxazol-5-amine?
The IUPAC name of N-Ethyl-3-methyl-1,2-oxazol-5-amine (CID 12446345) is N-ethyl-3-methyl-1,2-oxazol-5-amine.
What is the SMILES notation for N-Ethyl-3-methyl-1,2-oxazol-5-amine?
The canonical SMILES for N-Ethyl-3-methyl-1,2-oxazol-5-amine is CCNC1=CC(=NO1)C.
What is the InChIKey of N-Ethyl-3-methyl-1,2-oxazol-5-amine?
The InChIKey is GVONDJIPXGUCHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O/c1-3-7-6-4-5(2)8-9-6/h4,7H,3H2,1-2H3.
What are the key properties of N-Ethyl-3-methyl-1,2-oxazol-5-amine?
N-Ethyl-3-methyl-1,2-oxazol-5-amine has a molecular weight of 126.16 g/mol, XLogP of 1.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-Ethyl-3-methyl-1,2-oxazol-5-amine is sourced from PubChem (CID 12446345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).