3-[2-(cyclohepten-1-yl)-2-fluoropropyl]morpholine

C14H24FNO — CID 106655074

IUPAC3-[2-(cyclohepten-1-yl)-2-fluoropropyl]morpholine
SMILESCC(F)(CC1COCCN1)C1=CCCCCC1
InChIInChI=1S/C14H24FNO/c1-14(15,10-13-11-17-9-8-16-13)12-6-4-2-3-5-7-12/h6,13,16H,2-5,7-11H2,1H3
InChIKeyZPUFVONMIDSBGU-UHFFFAOYSA-N
MW241.35 g/mol
LogP2.98
Rot. Bonds3

About 3-[2-(cyclohepten-1-yl)-2-fluoropropyl]morpholine

3-[2-(cyclohepten-1-yl)-2-fluoropropyl]morpholine (PubChem CID 106655074) has the molecular formula C14H24FNO and a molecular weight of 241.35 g/mol. Its IUPAC name is 3-[2-(cyclohepten-1-yl)-2-fluoropropyl]morpholine.

Molecular Properties

Compound Name3-[2-(cyclohepten-1-yl)-2-fluoropropyl]morpholine
PubChem CID106655074
Molecular FormulaC14H24FNO
Molecular Weight241.35 g/mol
Exact Mass241.18
IUPAC Name3-[2-(cyclohepten-1-yl)-2-fluoropropyl]morpholine
SMILESCC(F)(CC1COCCN1)C1=CCCCCC1
InChIInChI=1S/C14H24FNO/c1-14(15,10-13-11-17-9-8-16-13)12-6-4-2-3-5-7-12/h6,13,16H,2-5,7-11H2,1H3
InChIKeyZPUFVONMIDSBGU-UHFFFAOYSA-N
XLogP2.98
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.35
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(3S)-3-[5-(2-fluoropropan-2-yl)-2-bicyclo[5.1.0]octa-1(8),3,5-trienyl]morpholine
CID 145012027
4-Fluoro-2-[6-(2-methylprop-1-enyl)oxan-2-yl]-4-(2-methylpropyl)piperidine
CID 146488690
1-(cyclohexen-1-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103207503
1-(cyclohepten-1-yl)-N-ethyl-2-(2,2,2-trifluoroethoxy)ethanamine
CID 103207523
N-[1-(cyclohepten-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]propan-1-amine
CID 103207525
3-[2-(Cyclohexen-1-yl)-2-fluoropropyl]morpholine
CID 106655073
N-[1-(cyclohexen-1-yl)-2-(2,2,2-trifluoroethoxy)ethyl]propan-1-amine
CID 113788173
3-[2-(Cycloocten-1-yl)-2-fluoropropyl]morpholine
CID 113860683
3-(2-Fluoro-2-methylpent-4-enyl)morpholine
CID 116011189
3-(2-Fluoro-2,4-dimethylpent-3-enyl)morpholine
CID 116011290
3-(2-Fluoro-2,3-dimethylbut-3-enyl)morpholine
CID 116011342
3-[2-(3,4-dihydro-2H-pyran-5-yl)-2-fluoropropyl]morpholine
CID 116011395

Frequently Asked Questions

What is the IUPAC name of 3-[2-(cyclohepten-1-yl)-2-fluoropropyl]morpholine?
The IUPAC name of 3-[2-(cyclohepten-1-yl)-2-fluoropropyl]morpholine (CID 106655074) is 3-[2-(cyclohepten-1-yl)-2-fluoropropyl]morpholine.
What is the SMILES notation for 3-[2-(cyclohepten-1-yl)-2-fluoropropyl]morpholine?
The canonical SMILES for 3-[2-(cyclohepten-1-yl)-2-fluoropropyl]morpholine is CC(F)(CC1COCCN1)C1=CCCCCC1.
What is the InChIKey of 3-[2-(cyclohepten-1-yl)-2-fluoropropyl]morpholine?
The InChIKey is ZPUFVONMIDSBGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24FNO/c1-14(15,10-13-11-17-9-8-16-13)12-6-4-2-3-5-7-12/h6,13,16H,2-5,7-11H2,1H3.
What are the key properties of 3-[2-(cyclohepten-1-yl)-2-fluoropropyl]morpholine?
3-[2-(cyclohepten-1-yl)-2-fluoropropyl]morpholine has a molecular weight of 241.35 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(cyclohepten-1-yl)-2-fluoropropyl]morpholine is sourced from PubChem (CID 106655074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).