3-[(Z)-3-(4-fluoro-2-methylphenyl)-2-methylprop-2-enyl]morpholine

C15H20FNO — CID 114350103

IUPAC3-[(Z)-3-(4-fluoro-2-methylphenyl)-2-methylprop-2-enyl]morpholine
SMILESC/C(=C/c1ccc(F)cc1C)CC1COCCN1
InChIInChI=1S/C15H20FNO/c1-11(8-15-10-18-6-5-17-15)7-13-3-4-14(16)9-12(13)2/h3-4,7,9,15,17H,5-6,8,10H2,1-2H3/b11-7-
InChIKeyBVNICVYYQUEFDQ-XFFZJAGNSA-N
MW249.33 g/mol
LogP2.92
Rot. Bonds3

About 3-[(Z)-3-(4-fluoro-2-methylphenyl)-2-methylprop-2-enyl]morpholine

3-[(Z)-3-(4-fluoro-2-methylphenyl)-2-methylprop-2-enyl]morpholine (PubChem CID 114350103) has the molecular formula C15H20FNO and a molecular weight of 249.33 g/mol. Its IUPAC name is 3-[(Z)-3-(4-fluoro-2-methylphenyl)-2-methylprop-2-enyl]morpholine.

Molecular Properties

Compound Name3-[(Z)-3-(4-fluoro-2-methylphenyl)-2-methylprop-2-enyl]morpholine
PubChem CID114350103
Molecular FormulaC15H20FNO
Molecular Weight249.33 g/mol
Exact Mass249.15
IUPAC Name3-[(Z)-3-(4-fluoro-2-methylphenyl)-2-methylprop-2-enyl]morpholine
SMILESC/C(=C/c1ccc(F)cc1C)CC1COCCN1
InChIInChI=1S/C15H20FNO/c1-11(8-15-10-18-6-5-17-15)7-13-3-4-14(16)9-12(13)2/h3-4,7,9,15,17H,5-6,8,10H2,1-2H3/b11-7-
InChIKeyBVNICVYYQUEFDQ-XFFZJAGNSA-N
XLogP2.92
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.33
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(Z)-3-(2,4-difluorophenyl)-2-methylprop-2-enyl]morpholine
CID 113462313
3-[(Z)-3-(2-chloro-5-fluorophenyl)-2-methylprop-2-enyl]morpholine
CID 102621780
3-[(Z)-3-(3,4-dichlorophenyl)-2-methylprop-2-enyl]morpholine
CID 113462311
1-(2,5-difluorophenyl)-2-morpholin-3-ylethanone
CID 81466302
1-(2,4-difluorophenyl)-2-morpholin-3-ylethanone
CID 81465797
1-(2,5-difluorophenyl)-3-morpholin-3-ylpropan-2-one
CID 116595683
1-(2,4-difluorophenyl)-2-morpholin-3-ylethanol
CID 81467090
N-[(1S)-1-(4-fluorophenyl)ethyl]-2-morpholin-3-ylacetamide
CID 81349518
3-[2-(3-fluoro-4-methylphenyl)ethyl]morpholine
CID 104704060
3-[(5-fluoro-2-methoxyphenyl)methyl]morpholine
CID 82287541
3-methyl-1-morpholin-3-ylbut-3-en-2-one
CID 116595710
3-[2-methyl-4-(2-methylpyrazol-3-yl)but-2-enyl]morpholine
CID 103019542

Frequently Asked Questions

What is the IUPAC name of 3-[(Z)-3-(4-fluoro-2-methylphenyl)-2-methylprop-2-enyl]morpholine?
The IUPAC name of 3-[(Z)-3-(4-fluoro-2-methylphenyl)-2-methylprop-2-enyl]morpholine (CID 114350103) is 3-[(Z)-3-(4-fluoro-2-methylphenyl)-2-methylprop-2-enyl]morpholine.
What is the SMILES notation for 3-[(Z)-3-(4-fluoro-2-methylphenyl)-2-methylprop-2-enyl]morpholine?
The canonical SMILES for 3-[(Z)-3-(4-fluoro-2-methylphenyl)-2-methylprop-2-enyl]morpholine is C/C(=C/c1ccc(F)cc1C)CC1COCCN1.
What is the InChIKey of 3-[(Z)-3-(4-fluoro-2-methylphenyl)-2-methylprop-2-enyl]morpholine?
The InChIKey is BVNICVYYQUEFDQ-XFFZJAGNSA-N. The full InChI is InChI=1S/C15H20FNO/c1-11(8-15-10-18-6-5-17-15)7-13-3-4-14(16)9-12(13)2/h3-4,7,9,15,17H,5-6,8,10H2,1-2H3/b11-7-.
What are the key properties of 3-[(Z)-3-(4-fluoro-2-methylphenyl)-2-methylprop-2-enyl]morpholine?
3-[(Z)-3-(4-fluoro-2-methylphenyl)-2-methylprop-2-enyl]morpholine has a molecular weight of 249.33 g/mol, XLogP of 2.92, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(Z)-3-(4-fluoro-2-methylphenyl)-2-methylprop-2-enyl]morpholine is sourced from PubChem (CID 114350103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).