1-(3-cyclobutyl-1,2-oxazol-5-yl)-N-methylmethanamine

C9H14N2O — CID 83845888

IUPAC1-(3-cyclobutyl-1,2-oxazol-5-yl)-N-methylmethanamine
SMILESCNCc1cc(C2CCC2)no1
InChIInChI=1S/C9H14N2O/c1-10-6-8-5-9(11-12-8)7-3-2-4-7/h5,7,10H,2-4,6H2,1H3
InChIKeyYUIUQZKLODFZHD-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.66
Rot. Bonds3

About 1-(3-cyclobutyl-1,2-oxazol-5-yl)-N-methylmethanamine

1-(3-cyclobutyl-1,2-oxazol-5-yl)-N-methylmethanamine (PubChem CID 83845888) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is 1-(3-cyclobutyl-1,2-oxazol-5-yl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3-cyclobutyl-1,2-oxazol-5-yl)-N-methylmethanamine
PubChem CID83845888
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC Name1-(3-cyclobutyl-1,2-oxazol-5-yl)-N-methylmethanamine
SMILESCNCc1cc(C2CCC2)no1
InChIInChI=1S/C9H14N2O/c1-10-6-8-5-9(11-12-8)7-3-2-4-7/h5,7,10H,2-4,6H2,1H3
InChIKeyYUIUQZKLODFZHD-UHFFFAOYSA-N
XLogP1.66
TPSA38.06 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 ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-cyclobutyl-1,2-oxazol-5-yl)-N-methylmethanamine?
The IUPAC name of 1-(3-cyclobutyl-1,2-oxazol-5-yl)-N-methylmethanamine (CID 83845888) is 1-(3-cyclobutyl-1,2-oxazol-5-yl)-N-methylmethanamine.
What is the SMILES notation for 1-(3-cyclobutyl-1,2-oxazol-5-yl)-N-methylmethanamine?
The canonical SMILES for 1-(3-cyclobutyl-1,2-oxazol-5-yl)-N-methylmethanamine is CNCc1cc(C2CCC2)no1.
What is the InChIKey of 1-(3-cyclobutyl-1,2-oxazol-5-yl)-N-methylmethanamine?
The InChIKey is YUIUQZKLODFZHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-10-6-8-5-9(11-12-8)7-3-2-4-7/h5,7,10H,2-4,6H2,1H3.
What are the key properties of 1-(3-cyclobutyl-1,2-oxazol-5-yl)-N-methylmethanamine?
1-(3-cyclobutyl-1,2-oxazol-5-yl)-N-methylmethanamine has a molecular weight of 166.22 g/mol, XLogP of 1.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-cyclobutyl-1,2-oxazol-5-yl)-N-methylmethanamine is sourced from PubChem (CID 83845888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).