5-methyl-N-propan-2-yl-1,3-oxazol-2-amine

C7H12N2O — CID 90064526

IUPAC5-methyl-N-propan-2-yl-1,3-oxazol-2-amine
SMILESCc1cnc(NC(C)C)o1
InChIInChI=1S/C7H12N2O/c1-5(2)9-7-8-4-6(3)10-7/h4-5H,1-3H3,(H,8,9)
InChIKeyQLAHXCJGMMYGNW-UHFFFAOYSA-N
MW140.19 g/mol
LogP1.80
Rot. Bonds2

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

5-methyl-N-propan-2-yl-1,3-oxazol-2-amine (PubChem CID 90064526) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is 5-methyl-N-propan-2-yl-1,3-oxazol-2-amine.

Molecular Properties

Compound Name5-methyl-N-propan-2-yl-1,3-oxazol-2-amine
PubChem CID90064526
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name5-methyl-N-propan-2-yl-1,3-oxazol-2-amine
SMILESCc1cnc(NC(C)C)o1
InChIInChI=1S/C7H12N2O/c1-5(2)9-7-8-4-6(3)10-7/h4-5H,1-3H3,(H,8,9)
InChIKeyQLAHXCJGMMYGNW-UHFFFAOYSA-N
XLogP1.80
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-methyl-N-propan-2-yl-1,3-oxazol-2-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 5-methyl-N-propan-2-yl-1,3-oxazol-2-amine?
The IUPAC name of 5-methyl-N-propan-2-yl-1,3-oxazol-2-amine (CID 90064526) is 5-methyl-N-propan-2-yl-1,3-oxazol-2-amine.
What is the SMILES notation for 5-methyl-N-propan-2-yl-1,3-oxazol-2-amine?
The canonical SMILES for 5-methyl-N-propan-2-yl-1,3-oxazol-2-amine is Cc1cnc(NC(C)C)o1.
What is the InChIKey of 5-methyl-N-propan-2-yl-1,3-oxazol-2-amine?
The InChIKey is QLAHXCJGMMYGNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c1-5(2)9-7-8-4-6(3)10-7/h4-5H,1-3H3,(H,8,9).
What are the key properties of 5-methyl-N-propan-2-yl-1,3-oxazol-2-amine?
5-methyl-N-propan-2-yl-1,3-oxazol-2-amine has a molecular weight of 140.19 g/mol, XLogP of 1.80, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-propan-2-yl-1,3-oxazol-2-amine is sourced from PubChem (CID 90064526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).