N-methyl-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine

C12H14N2O — CID 65181733

IUPACN-methyl-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine
SMILESCNC(C)c1ncc(-c2ccccc2)o1
InChIInChI=1S/C12H14N2O/c1-9(13-2)12-14-8-11(15-12)10-6-4-3-5-7-10/h3-9,13H,1-2H3
InChIKeySGGCKYBNBKXEBG-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.62
Rot. Bonds3

About N-methyl-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine

N-methyl-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine (PubChem CID 65181733) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is N-methyl-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine
PubChem CID65181733
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC NameN-methyl-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine
SMILESCNC(C)c1ncc(-c2ccccc2)o1
InChIInChI=1S/C12H14N2O/c1-9(13-2)12-14-8-11(15-12)10-6-4-3-5-7-10/h3-9,13H,1-2H3
InChIKeySGGCKYBNBKXEBG-UHFFFAOYSA-N
XLogP2.62
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine?
The IUPAC name of N-methyl-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine (CID 65181733) is N-methyl-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine.
What is the SMILES notation for N-methyl-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine?
The canonical SMILES for N-methyl-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine is CNC(C)c1ncc(-c2ccccc2)o1.
What is the InChIKey of N-methyl-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine?
The InChIKey is SGGCKYBNBKXEBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-9(13-2)12-14-8-11(15-12)10-6-4-3-5-7-10/h3-9,13H,1-2H3.
What are the key properties of N-methyl-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine?
N-methyl-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine has a molecular weight of 202.26 g/mol, XLogP of 2.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-phenyl-1,3-oxazol-2-yl)ethanamine is sourced from PubChem (CID 65181733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).