4-[(2-fluoro-4-piperidin-3-ylphenyl)methyl]morpholine

C16H23FN2O — CID 117446553

IUPAC4-[(2-fluoro-4-piperidin-3-ylphenyl)methyl]morpholine
SMILESFc1cc(C2CCCNC2)ccc1CN1CCOCC1
InChIInChI=1S/C16H23FN2O/c17-16-10-13(14-2-1-5-18-11-14)3-4-15(16)12-19-6-8-20-9-7-19/h3-4,10,14,18H,1-2,5-9,11-12H2
InChIKeyRXJZIPMESJYHSI-UHFFFAOYSA-N
MW278.37 g/mol
LogP2.12
Rot. Bonds3

About 4-[(2-fluoro-4-piperidin-3-ylphenyl)methyl]morpholine

4-[(2-fluoro-4-piperidin-3-ylphenyl)methyl]morpholine (PubChem CID 117446553) has the molecular formula C16H23FN2O and a molecular weight of 278.37 g/mol. Its IUPAC name is 4-[(2-fluoro-4-piperidin-3-ylphenyl)methyl]morpholine.

Molecular Properties

Compound Name4-[(2-fluoro-4-piperidin-3-ylphenyl)methyl]morpholine
PubChem CID117446553
Molecular FormulaC16H23FN2O
Molecular Weight278.37 g/mol
Exact Mass278.18
IUPAC Name4-[(2-fluoro-4-piperidin-3-ylphenyl)methyl]morpholine
SMILESFc1cc(C2CCCNC2)ccc1CN1CCOCC1
InChIInChI=1S/C16H23FN2O/c17-16-10-13(14-2-1-5-18-11-14)3-4-15(16)12-19-6-8-20-9-7-19/h3-4,10,14,18H,1-2,5-9,11-12H2
InChIKeyRXJZIPMESJYHSI-UHFFFAOYSA-N
XLogP2.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2-chloro-4-pyrrolidin-3-ylphenyl)methyl]morpholine
CID 117450927
2-[3-fluoro-4-(piperidin-1-ylmethyl)phenyl]morpholine
CID 117446560
1-[(2-fluoro-4-pyrrolidin-2-ylphenyl)methyl]piperidine
CID 117411013
2-fluoro-4-piperidin-3-ylphenol
CID 82606236
[5-[3-fluoro-4-(morpholin-4-ylmethyl)phenyl]-1-methylpyrrolidin-3-yl]methanamine
CID 117492434
1-(2-fluoro-4-piperidin-3-ylphenyl)-4-methylpiperazine
CID 117444808
2-fluoro-5-[(3S)-piperidin-3-yl]aniline
CID 93478585
2-fluoro-4-piperidin-3-ylbenzaldehyde;hydrochloride
CID 175797855
3-[3-fluoro-4-(1,4-oxazepan-4-ylmethyl)phenyl]prop-2-enoic acid
CID 76979620
N-[1-(morpholin-4-ylmethyl)cyclopentyl]-4-[(3S)-piperidin-3-yl]benzamide
CID 97204061
3-(1,3-benzodioxol-5-yl)piperidine
CID 66727486
4-[(2-piperidin-3-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)methyl]-1,4-oxazepane;hydrochloride
CID 118741935

Frequently Asked Questions

What is the IUPAC name of 4-[(2-fluoro-4-piperidin-3-ylphenyl)methyl]morpholine?
The IUPAC name of 4-[(2-fluoro-4-piperidin-3-ylphenyl)methyl]morpholine (CID 117446553) is 4-[(2-fluoro-4-piperidin-3-ylphenyl)methyl]morpholine.
What is the SMILES notation for 4-[(2-fluoro-4-piperidin-3-ylphenyl)methyl]morpholine?
The canonical SMILES for 4-[(2-fluoro-4-piperidin-3-ylphenyl)methyl]morpholine is Fc1cc(C2CCCNC2)ccc1CN1CCOCC1.
What is the InChIKey of 4-[(2-fluoro-4-piperidin-3-ylphenyl)methyl]morpholine?
The InChIKey is RXJZIPMESJYHSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23FN2O/c17-16-10-13(14-2-1-5-18-11-14)3-4-15(16)12-19-6-8-20-9-7-19/h3-4,10,14,18H,1-2,5-9,11-12H2.
What are the key properties of 4-[(2-fluoro-4-piperidin-3-ylphenyl)methyl]morpholine?
4-[(2-fluoro-4-piperidin-3-ylphenyl)methyl]morpholine has a molecular weight of 278.37 g/mol, XLogP of 2.12, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-fluoro-4-piperidin-3-ylphenyl)methyl]morpholine is sourced from PubChem (CID 117446553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).