1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine

C14H17FN2O2 — CID 107716681

IUPAC1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine
SMILESCNC(C)c1ccc(OCc2cc(C)no2)cc1F
InChIInChI=1S/C14H17FN2O2/c1-9-6-12(19-17-9)8-18-11-4-5-13(10(2)16-3)14(15)7-11/h4-7,10,16H,8H2,1-3H3
InChIKeyDOHAHFLLEUMPCB-UHFFFAOYSA-N
MW264.30 g/mol
LogP2.98
Rot. Bonds5

About 1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine

1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine (PubChem CID 107716681) has the molecular formula C14H17FN2O2 and a molecular weight of 264.30 g/mol. Its IUPAC name is 1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine.

Molecular Properties

Compound Name1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine
PubChem CID107716681
Molecular FormulaC14H17FN2O2
Molecular Weight264.30 g/mol
Exact Mass264.13
IUPAC Name1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine
SMILESCNC(C)c1ccc(OCc2cc(C)no2)cc1F
InChIInChI=1S/C14H17FN2O2/c1-9-6-12(19-17-9)8-18-11-4-5-13(10(2)16-3)14(15)7-11/h4-7,10,16H,8H2,1-3H3
InChIKeyDOHAHFLLEUMPCB-UHFFFAOYSA-N
XLogP2.98
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.30
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-fluoro-4-(1,2,4-oxadiazol-3-ylmethoxy)phenyl]-N-methylethanamine
CID 107716494
5-[(3-fluorophenoxy)methyl]-3-methyl-1,2-oxazole
CID 60681199
1-[4-[(4-bromothiophen-2-yl)methoxy]-2-fluorophenyl]-N-methylethanamine
CID 107716897
2-[3-fluoro-4-[1-(methylamino)ethyl]phenoxy]-N-methylacetamide
CID 107716600
1-[2-fluoro-4-(4-methoxybutoxy)phenyl]-N-methylethanamine
CID 107716952
1-[4-[(2-bromo-4-fluorophenyl)methoxy]-2-fluorophenyl]-N-methylethanamine
CID 107716998
3-[3-fluoro-4-[1-(methylamino)ethyl]phenoxy]-2-methylpropanamide
CID 107716852
N-ethyl-1-[3-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine
CID 60887616
N-ethyl-1-[4-methoxy-2-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethanamine
CID 82000944
N-[1-[4-fluoro-2-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]ethyl]propan-1-amine
CID 63065346
1-(2-fluoro-4-pentan-2-yloxyphenyl)-N-methylethanamine
CID 107891171
3-[3-fluoro-4-[1-(methylamino)ethyl]phenoxy]-2,2-dimethylpropanoic acid
CID 107716703

Frequently Asked Questions

What is the IUPAC name of 1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine?
The IUPAC name of 1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine (CID 107716681) is 1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine.
What is the SMILES notation for 1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine?
The canonical SMILES for 1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine is CNC(C)c1ccc(OCc2cc(C)no2)cc1F.
What is the InChIKey of 1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine?
The InChIKey is DOHAHFLLEUMPCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O2/c1-9-6-12(19-17-9)8-18-11-4-5-13(10(2)16-3)14(15)7-11/h4-7,10,16H,8H2,1-3H3.
What are the key properties of 1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine?
1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine has a molecular weight of 264.30 g/mol, XLogP of 2.98, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-fluoro-4-[(3-methyl-1,2-oxazol-5-yl)methoxy]phenyl]-N-methylethanamine is sourced from PubChem (CID 107716681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).