N-methyl-2-[5-(oxan-2-yl)-1,3-oxazol-2-yl]ethanamine

C11H18N2O2 — CID 65183447

IUPACN-methyl-2-[5-(oxan-2-yl)-1,3-oxazol-2-yl]ethanamine
SMILESCNCCc1ncc(C2CCCCO2)o1
InChIInChI=1S/C11H18N2O2/c1-12-6-5-11-13-8-10(15-11)9-4-2-3-7-14-9/h8-9,12H,2-7H2,1H3
InChIKeyBAIRUFHTECVWFC-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.68
Rot. Bonds4

About N-methyl-2-[5-(oxan-2-yl)-1,3-oxazol-2-yl]ethanamine

N-methyl-2-[5-(oxan-2-yl)-1,3-oxazol-2-yl]ethanamine (PubChem CID 65183447) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-methyl-2-[5-(oxan-2-yl)-1,3-oxazol-2-yl]ethanamine.

Molecular Properties

Compound NameN-methyl-2-[5-(oxan-2-yl)-1,3-oxazol-2-yl]ethanamine
PubChem CID65183447
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC NameN-methyl-2-[5-(oxan-2-yl)-1,3-oxazol-2-yl]ethanamine
SMILESCNCCc1ncc(C2CCCCO2)o1
InChIInChI=1S/C11H18N2O2/c1-12-6-5-11-13-8-10(15-11)9-4-2-3-7-14-9/h8-9,12H,2-7H2,1H3
InChIKeyBAIRUFHTECVWFC-UHFFFAOYSA-N
XLogP1.68
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[5-(oxan-2-yl)-1,3-oxazol-2-yl]ethanamine?
The IUPAC name of N-methyl-2-[5-(oxan-2-yl)-1,3-oxazol-2-yl]ethanamine (CID 65183447) is N-methyl-2-[5-(oxan-2-yl)-1,3-oxazol-2-yl]ethanamine.
What is the SMILES notation for N-methyl-2-[5-(oxan-2-yl)-1,3-oxazol-2-yl]ethanamine?
The canonical SMILES for N-methyl-2-[5-(oxan-2-yl)-1,3-oxazol-2-yl]ethanamine is CNCCc1ncc(C2CCCCO2)o1.
What is the InChIKey of N-methyl-2-[5-(oxan-2-yl)-1,3-oxazol-2-yl]ethanamine?
The InChIKey is BAIRUFHTECVWFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-12-6-5-11-13-8-10(15-11)9-4-2-3-7-14-9/h8-9,12H,2-7H2,1H3.
What are the key properties of N-methyl-2-[5-(oxan-2-yl)-1,3-oxazol-2-yl]ethanamine?
N-methyl-2-[5-(oxan-2-yl)-1,3-oxazol-2-yl]ethanamine has a molecular weight of 210.28 g/mol, XLogP of 1.68, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[5-(oxan-2-yl)-1,3-oxazol-2-yl]ethanamine is sourced from PubChem (CID 65183447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).