4-[(3-chloro-2-fluorophenyl)methoxy]piperidine

C12H15ClFNO — CID 103695215

IUPAC4-[(3-chloro-2-fluorophenyl)methoxy]piperidine
SMILESFc1c(Cl)cccc1COC1CCNCC1
InChIInChI=1S/C12H15ClFNO/c13-11-3-1-2-9(12(11)14)8-16-10-4-6-15-7-5-10/h1-3,10,15H,4-8H2
InChIKeyGJEMYPWBGGJQCG-UHFFFAOYSA-N
MW243.71 g/mol
LogP2.75
Rot. Bonds3

About 4-[(3-chloro-2-fluorophenyl)methoxy]piperidine

4-[(3-chloro-2-fluorophenyl)methoxy]piperidine (PubChem CID 103695215) has the molecular formula C12H15ClFNO and a molecular weight of 243.71 g/mol. Its IUPAC name is 4-[(3-chloro-2-fluorophenyl)methoxy]piperidine.

Molecular Properties

Compound Name4-[(3-chloro-2-fluorophenyl)methoxy]piperidine
PubChem CID103695215
Molecular FormulaC12H15ClFNO
Molecular Weight243.71 g/mol
Exact Mass243.08
IUPAC Name4-[(3-chloro-2-fluorophenyl)methoxy]piperidine
SMILESFc1c(Cl)cccc1COC1CCNCC1
InChIInChI=1S/C12H15ClFNO/c13-11-3-1-2-9(12(11)14)8-16-10-4-6-15-7-5-10/h1-3,10,15H,4-8H2
InChIKeyGJEMYPWBGGJQCG-UHFFFAOYSA-N
XLogP2.75
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.71
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(1-fluoronaphthalen-2-yl)methoxy]piperidine;hydrochloride
CID 67594856
4-(naphthalen-1-ylmethoxy)piperidine
CID 13194444
2-(3-chloro-2-fluorophenyl)-1-pyrrolidin-3-ylethanone
CID 102865083
3-[(2,6-dichlorophenyl)methoxy]pyrrolidine
CID 62328259
1-(2,3-dichlorophenyl)-3-piperidin-4-yloxypropan-2-one
CID 107311349
3-chloro-2-fluoro-N-(3-piperidin-4-yloxypropyl)benzamide
CID 81264988
(3S)-3-[(2-fluorophenyl)methoxy]pyrrolidine
CID 66520009
3-[(2-fluorophenyl)methoxy]pyrrolidine
CID 14497371
4-[(1-chloronaphthalen-2-yl)methoxy]piperidine
CID 67594155
4-[(2,3,6-trifluorophenyl)methoxy]piperidine
CID 68519539
3-chloro-4-(piperidin-4-yloxymethyl)benzamide
CID 102668830
3-[(2,3-dichlorophenyl)methoxy]piperidine
CID 107306986

Frequently Asked Questions

What is the IUPAC name of 4-[(3-chloro-2-fluorophenyl)methoxy]piperidine?
The IUPAC name of 4-[(3-chloro-2-fluorophenyl)methoxy]piperidine (CID 103695215) is 4-[(3-chloro-2-fluorophenyl)methoxy]piperidine.
What is the SMILES notation for 4-[(3-chloro-2-fluorophenyl)methoxy]piperidine?
The canonical SMILES for 4-[(3-chloro-2-fluorophenyl)methoxy]piperidine is Fc1c(Cl)cccc1COC1CCNCC1.
What is the InChIKey of 4-[(3-chloro-2-fluorophenyl)methoxy]piperidine?
The InChIKey is GJEMYPWBGGJQCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClFNO/c13-11-3-1-2-9(12(11)14)8-16-10-4-6-15-7-5-10/h1-3,10,15H,4-8H2.
What are the key properties of 4-[(3-chloro-2-fluorophenyl)methoxy]piperidine?
4-[(3-chloro-2-fluorophenyl)methoxy]piperidine has a molecular weight of 243.71 g/mol, XLogP of 2.75, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-chloro-2-fluorophenyl)methoxy]piperidine is sourced from PubChem (CID 103695215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).