2-[1-(4-methyl-1,3-oxazol-5-yl)cyclopropyl]ethanamine

C9H14N2O — CID 96632975

IUPAC2-[1-(4-methyl-1,3-oxazol-5-yl)cyclopropyl]ethanamine
SMILESCc1ncoc1C1(CCN)CC1
InChIInChI=1S/C9H14N2O/c1-7-8(12-6-11-7)9(2-3-9)4-5-10/h6H,2-5,10H2,1H3
InChIKeyZWOZJTBHHQCRLI-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.36
Rot. Bonds3

About 2-[1-(4-methyl-1,3-oxazol-5-yl)cyclopropyl]ethanamine

2-[1-(4-methyl-1,3-oxazol-5-yl)cyclopropyl]ethanamine (PubChem CID 96632975) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 2-[1-(4-methyl-1,3-oxazol-5-yl)cyclopropyl]ethanamine.

Molecular Properties

Compound Name2-[1-(4-methyl-1,3-oxazol-5-yl)cyclopropyl]ethanamine
PubChem CID96632975
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name2-[1-(4-methyl-1,3-oxazol-5-yl)cyclopropyl]ethanamine
SMILESCc1ncoc1C1(CCN)CC1
InChIInChI=1S/C9H14N2O/c1-7-8(12-6-11-7)9(2-3-9)4-5-10/h6H,2-5,10H2,1H3
InChIKeyZWOZJTBHHQCRLI-UHFFFAOYSA-N
XLogP1.36
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[1-(4-methyl-1,3-oxazol-5-yl)cyclopropyl]ethanamine 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 2-[1-(4-methyl-1,3-oxazol-5-yl)cyclopropyl]ethanamine?
The IUPAC name of 2-[1-(4-methyl-1,3-oxazol-5-yl)cyclopropyl]ethanamine (CID 96632975) is 2-[1-(4-methyl-1,3-oxazol-5-yl)cyclopropyl]ethanamine.
What is the SMILES notation for 2-[1-(4-methyl-1,3-oxazol-5-yl)cyclopropyl]ethanamine?
The canonical SMILES for 2-[1-(4-methyl-1,3-oxazol-5-yl)cyclopropyl]ethanamine is Cc1ncoc1C1(CCN)CC1.
What is the InChIKey of 2-[1-(4-methyl-1,3-oxazol-5-yl)cyclopropyl]ethanamine?
The InChIKey is ZWOZJTBHHQCRLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-7-8(12-6-11-7)9(2-3-9)4-5-10/h6H,2-5,10H2,1H3.
What are the key properties of 2-[1-(4-methyl-1,3-oxazol-5-yl)cyclopropyl]ethanamine?
2-[1-(4-methyl-1,3-oxazol-5-yl)cyclopropyl]ethanamine has a molecular weight of 166.22 g/mol, XLogP of 1.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-methyl-1,3-oxazol-5-yl)cyclopropyl]ethanamine is sourced from PubChem (CID 96632975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).