3,4-dimethyl-N-propan-2-yl-1,2-oxazol-5-amine

C8H14N2O — CID 56994718

IUPAC3,4-dimethyl-N-propan-2-yl-1,2-oxazol-5-amine
SMILESCc1noc(NC(C)C)c1C
InChIInChI=1S/C8H14N2O/c1-5(2)9-8-6(3)7(4)10-11-8/h5,9H,1-4H3
InChIKeyYQMPCIUVJHQVRZ-UHFFFAOYSA-N
MW154.21 g/mol
LogP2.11
Rot. Bonds2

About 3,4-dimethyl-N-propan-2-yl-1,2-oxazol-5-amine

3,4-dimethyl-N-propan-2-yl-1,2-oxazol-5-amine (PubChem CID 56994718) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 3,4-dimethyl-N-propan-2-yl-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3,4-dimethyl-N-propan-2-yl-1,2-oxazol-5-amine
PubChem CID56994718
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name3,4-dimethyl-N-propan-2-yl-1,2-oxazol-5-amine
SMILESCc1noc(NC(C)C)c1C
InChIInChI=1S/C8H14N2O/c1-5(2)9-8-6(3)7(4)10-11-8/h5,9H,1-4H3
InChIKeyYQMPCIUVJHQVRZ-UHFFFAOYSA-N
XLogP2.11
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3,4-dimethyl-N-propan-2-yl-1,2-oxazol-5-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-N-propan-2-yl-1,2-oxazol-5-amine?
The IUPAC name of 3,4-dimethyl-N-propan-2-yl-1,2-oxazol-5-amine (CID 56994718) is 3,4-dimethyl-N-propan-2-yl-1,2-oxazol-5-amine.
What is the SMILES notation for 3,4-dimethyl-N-propan-2-yl-1,2-oxazol-5-amine?
The canonical SMILES for 3,4-dimethyl-N-propan-2-yl-1,2-oxazol-5-amine is Cc1noc(NC(C)C)c1C.
What is the InChIKey of 3,4-dimethyl-N-propan-2-yl-1,2-oxazol-5-amine?
The InChIKey is YQMPCIUVJHQVRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-5(2)9-8-6(3)7(4)10-11-8/h5,9H,1-4H3.
What are the key properties of 3,4-dimethyl-N-propan-2-yl-1,2-oxazol-5-amine?
3,4-dimethyl-N-propan-2-yl-1,2-oxazol-5-amine has a molecular weight of 154.21 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-N-propan-2-yl-1,2-oxazol-5-amine is sourced from PubChem (CID 56994718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).