3-fluoro-3-(2-phenylcyclopropyl)piperidine

C14H18FN — CID 116518677

IUPAC3-fluoro-3-(2-phenylcyclopropyl)piperidine
SMILESFC1(C2CC2c2ccccc2)CCCNC1
InChIInChI=1S/C14H18FN/c15-14(7-4-8-16-10-14)13-9-12(13)11-5-2-1-3-6-11/h1-3,5-6,12-13,16H,4,7-10H2
InChIKeyNXGYMRGXCHTQKH-UHFFFAOYSA-N
MW219.30 g/mol
LogP2.88
Rot. Bonds2

About 3-fluoro-3-(2-phenylcyclopropyl)piperidine

3-fluoro-3-(2-phenylcyclopropyl)piperidine (PubChem CID 116518677) has the molecular formula C14H18FN and a molecular weight of 219.30 g/mol. Its IUPAC name is 3-fluoro-3-(2-phenylcyclopropyl)piperidine.

Molecular Properties

Compound Name3-fluoro-3-(2-phenylcyclopropyl)piperidine
PubChem CID116518677
Molecular FormulaC14H18FN
Molecular Weight219.30 g/mol
Exact Mass219.14
IUPAC Name3-fluoro-3-(2-phenylcyclopropyl)piperidine
SMILESFC1(C2CC2c2ccccc2)CCCNC1
InChIInChI=1S/C14H18FN/c15-14(7-4-8-16-10-14)13-9-12(13)11-5-2-1-3-6-11/h1-3,5-6,12-13,16H,4,7-10H2
InChIKeyNXGYMRGXCHTQKH-UHFFFAOYSA-N
XLogP2.88
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.30
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[2-[1-(bromomethyl)cyclopropyl]cyclopropyl]benzene
CID 116518517
N-[(3-methylpiperidin-3-yl)methyl]-2-phenylcyclopropan-1-amine
CID 63133645
(4R)-3,3-difluoro-4-phenylpiperidine
CID 97032408
N-[(3-ethylpiperidin-3-yl)methyl]-2-phenylcyclopropan-1-amine
CID 63133644
(3R)-3-phenylspiro[2,3,6,7,8,8a-hexahydro-[1,3]oxazolo[3,2-a]pyridine-5,3'-piperidine]
CID 134926302
6-phenyl-1,9-diazaspiro[4.5]decane
CID 91595107
(3R,4R)-3,4-diphenylazepane;ethane
CID 123989610
3-(2,5-dihydro-1H-pyrrol-2-yl)-3-fluoropiperidine
CID 130510906
2-phenyl-5-azaspiro[2.4]heptane
CID 84654707
(2R,3S)-2-phenyl-5-azaspiro[2.4]heptane
CID 121315230
3-(3-cyclobutylphenyl)-3-fluoropiperidine
CID 114607384
3-fluoro-3-(2-methylphenyl)piperidine
CID 83818332

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-3-(2-phenylcyclopropyl)piperidine?
The IUPAC name of 3-fluoro-3-(2-phenylcyclopropyl)piperidine (CID 116518677) is 3-fluoro-3-(2-phenylcyclopropyl)piperidine.
What is the SMILES notation for 3-fluoro-3-(2-phenylcyclopropyl)piperidine?
The canonical SMILES for 3-fluoro-3-(2-phenylcyclopropyl)piperidine is FC1(C2CC2c2ccccc2)CCCNC1.
What is the InChIKey of 3-fluoro-3-(2-phenylcyclopropyl)piperidine?
The InChIKey is NXGYMRGXCHTQKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FN/c15-14(7-4-8-16-10-14)13-9-12(13)11-5-2-1-3-6-11/h1-3,5-6,12-13,16H,4,7-10H2.
What are the key properties of 3-fluoro-3-(2-phenylcyclopropyl)piperidine?
3-fluoro-3-(2-phenylcyclopropyl)piperidine has a molecular weight of 219.30 g/mol, XLogP of 2.88, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-3-(2-phenylcyclopropyl)piperidine is sourced from PubChem (CID 116518677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).