2-methyl-N-(1,2-oxazol-5-ylmethyl)propan-1-amine

C8H14N2O — CID 60686052

IUPAC2-methyl-N-(1,2-oxazol-5-ylmethyl)propan-1-amine
SMILESCC(C)CNCc1ccno1
InChIInChI=1S/C8H14N2O/c1-7(2)5-9-6-8-3-4-10-11-8/h3-4,7,9H,5-6H2,1-2H3
InChIKeyJUOBOGIJLFELDR-UHFFFAOYSA-N
MW154.21 g/mol
LogP1.42
Rot. Bonds4

About 2-methyl-N-(1,2-oxazol-5-ylmethyl)propan-1-amine

2-methyl-N-(1,2-oxazol-5-ylmethyl)propan-1-amine (PubChem CID 60686052) has the molecular formula C8H14N2O and a molecular weight of 154.21 g/mol. Its IUPAC name is 2-methyl-N-(1,2-oxazol-5-ylmethyl)propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-(1,2-oxazol-5-ylmethyl)propan-1-amine
PubChem CID60686052
Molecular FormulaC8H14N2O
Molecular Weight154.21 g/mol
Exact Mass154.11
IUPAC Name2-methyl-N-(1,2-oxazol-5-ylmethyl)propan-1-amine
SMILESCC(C)CNCc1ccno1
InChIInChI=1S/C8H14N2O/c1-7(2)5-9-6-8-3-4-10-11-8/h3-4,7,9H,5-6H2,1-2H3
InChIKeyJUOBOGIJLFELDR-UHFFFAOYSA-N
XLogP1.42
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.21
LogP ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1,2-oxazol-5-ylmethyl)propan-1-amine?
The IUPAC name of 2-methyl-N-(1,2-oxazol-5-ylmethyl)propan-1-amine (CID 60686052) is 2-methyl-N-(1,2-oxazol-5-ylmethyl)propan-1-amine.
What is the SMILES notation for 2-methyl-N-(1,2-oxazol-5-ylmethyl)propan-1-amine?
The canonical SMILES for 2-methyl-N-(1,2-oxazol-5-ylmethyl)propan-1-amine is CC(C)CNCc1ccno1.
What is the InChIKey of 2-methyl-N-(1,2-oxazol-5-ylmethyl)propan-1-amine?
The InChIKey is JUOBOGIJLFELDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O/c1-7(2)5-9-6-8-3-4-10-11-8/h3-4,7,9H,5-6H2,1-2H3.
What are the key properties of 2-methyl-N-(1,2-oxazol-5-ylmethyl)propan-1-amine?
2-methyl-N-(1,2-oxazol-5-ylmethyl)propan-1-amine has a molecular weight of 154.21 g/mol, XLogP of 1.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1,2-oxazol-5-ylmethyl)propan-1-amine is sourced from PubChem (CID 60686052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).