4-(3-fluoroprop-1-en-2-yl)-2-methyl-5-phenylmorpholine

C14H18FNO — CID 142383852

IUPAC4-(3-fluoroprop-1-en-2-yl)-2-methyl-5-phenylmorpholine
SMILESC=C(CF)N1CC(C)OCC1c1ccccc1
InChIInChI=1S/C14H18FNO/c1-11(8-15)16-9-12(2)17-10-14(16)13-6-4-3-5-7-13/h3-7,12,14H,1,8-10H2,2H3
InChIKeyABROBHVLONNIDL-UHFFFAOYSA-N
MW235.30 g/mol
LogP2.93
Rot. Bonds3

About 4-(3-fluoroprop-1-en-2-yl)-2-methyl-5-phenylmorpholine

4-(3-fluoroprop-1-en-2-yl)-2-methyl-5-phenylmorpholine (PubChem CID 142383852) has the molecular formula C14H18FNO and a molecular weight of 235.30 g/mol. Its IUPAC name is 4-(3-fluoroprop-1-en-2-yl)-2-methyl-5-phenylmorpholine.

Molecular Properties

Compound Name4-(3-fluoroprop-1-en-2-yl)-2-methyl-5-phenylmorpholine
PubChem CID142383852
Molecular FormulaC14H18FNO
Molecular Weight235.30 g/mol
Exact Mass235.14
IUPAC Name4-(3-fluoroprop-1-en-2-yl)-2-methyl-5-phenylmorpholine
SMILESC=C(CF)N1CC(C)OCC1c1ccccc1
InChIInChI=1S/C14H18FNO/c1-11(8-15)16-9-12(2)17-10-14(16)13-6-4-3-5-7-13/h3-7,12,14H,1,8-10H2,2H3
InChIKeyABROBHVLONNIDL-UHFFFAOYSA-N
XLogP2.93
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.30
LogP ≤ 52.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2-methyl-5-phenylmorpholin-4-yl)-(oxiran-2-yl)methanone
CID 154879876
2-(methylamino)-1-[(2S,5S)-2-methyl-5-phenylmorpholin-4-yl]ethanone
CID 124686301
(2S)-2-amino-1-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]butan-1-one
CID 124890111
2-amino-1-(2-methyl-5-phenylmorpholin-4-yl)pentan-1-one;hydrochloride
CID 119335324
2-(1-hydroxycyclopentyl)-1-(2-methyl-5-phenylmorpholin-4-yl)ethanone
CID 111540812
1-[(2S,5S)-2-methyl-5-phenylmorpholin-4-yl]-2-pyrimidin-5-ylethanone
CID 124882003
2-cyclopent-2-en-1-yl-1-(2-methyl-5-phenylmorpholin-4-yl)ethanone
CID 71993114
(3-hydroxy-2-pyridinyl)-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]methanone
CID 124572458
4-methyl-1-[2-[(2S,5R)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one
CID 124627784
4-methyl-1-[2-[(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-2-oxoethyl]pyridin-2-one
CID 124627783
[(2R,5S)-2-methyl-5-phenylmorpholin-4-yl]-[(2S)-morpholin-2-yl]methanone
CID 124694261
2-(fluoromethyl)-5-phenylmorpholine-4-carboxylic acid
CID 67469485

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluoroprop-1-en-2-yl)-2-methyl-5-phenylmorpholine?
The IUPAC name of 4-(3-fluoroprop-1-en-2-yl)-2-methyl-5-phenylmorpholine (CID 142383852) is 4-(3-fluoroprop-1-en-2-yl)-2-methyl-5-phenylmorpholine.
What is the SMILES notation for 4-(3-fluoroprop-1-en-2-yl)-2-methyl-5-phenylmorpholine?
The canonical SMILES for 4-(3-fluoroprop-1-en-2-yl)-2-methyl-5-phenylmorpholine is C=C(CF)N1CC(C)OCC1c1ccccc1.
What is the InChIKey of 4-(3-fluoroprop-1-en-2-yl)-2-methyl-5-phenylmorpholine?
The InChIKey is ABROBHVLONNIDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO/c1-11(8-15)16-9-12(2)17-10-14(16)13-6-4-3-5-7-13/h3-7,12,14H,1,8-10H2,2H3.
What are the key properties of 4-(3-fluoroprop-1-en-2-yl)-2-methyl-5-phenylmorpholine?
4-(3-fluoroprop-1-en-2-yl)-2-methyl-5-phenylmorpholine has a molecular weight of 235.30 g/mol, XLogP of 2.93, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluoroprop-1-en-2-yl)-2-methyl-5-phenylmorpholine is sourced from PubChem (CID 142383852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).