(4R)-3,3-difluoro-4-phenylpiperidine

C11H13F2N — CID 97032408

IUPAC(4R)-3,3-difluoro-4-phenylpiperidine
SMILESFC1(F)CNCC[C@@H]1c1ccccc1
InChIInChI=1S/C11H13F2N/c12-11(13)8-14-7-6-10(11)9-4-2-1-3-5-9/h1-5,10,14H,6-8H2/t10-/m1/s1
InChIKeyBAECOYBHZORNIT-SNVBAGLBSA-N
MW197.23 g/mol
LogP2.40
Rot. Bonds1

About (4R)-3,3-difluoro-4-phenylpiperidine

(4R)-3,3-difluoro-4-phenylpiperidine (PubChem CID 97032408) has the molecular formula C11H13F2N and a molecular weight of 197.23 g/mol. Its IUPAC name is (4R)-3,3-difluoro-4-phenylpiperidine.

Molecular Properties

Compound Name(4R)-3,3-difluoro-4-phenylpiperidine
PubChem CID97032408
Molecular FormulaC11H13F2N
Molecular Weight197.23 g/mol
Exact Mass197.10
IUPAC Name(4R)-3,3-difluoro-4-phenylpiperidine
SMILESFC1(F)CNCC[C@@H]1c1ccccc1
InChIInChI=1S/C11H13F2N/c12-11(13)8-14-7-6-10(11)9-4-2-1-3-5-9/h1-5,10,14H,6-8H2/t10-/m1/s1
InChIKeyBAECOYBHZORNIT-SNVBAGLBSA-N
XLogP2.40
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(4-chlorophenyl)-3,3-difluoropiperidine
CID 67962435
4-(3-bromophenyl)-3,3-difluoropiperidine
CID 105426890
3-(3,3-difluoropiperidin-4-yl)phenol
CID 105426893
(2,2-difluorocyclobutyl)benzene
CID 91804683
6-phenyl-1,9-diazaspiro[4.5]decane
CID 91595107
1-[4-(3,3-difluoropiperidin-4-yl)phenyl]-1,3-diazinane-2,4-dione
CID 170737571
2-phenyl-5-azaspiro[2.4]heptane
CID 84654707
(2R,3S)-2-phenyl-5-azaspiro[2.4]heptane
CID 121315230
(4R)-3,3-difluoro-N-methyl-N-[(1R)-1-phenylethyl]piperidin-4-amine
CID 154669081
ethane;3-phenylpyrrolidine
CID 91032726
7-phenyl-2-azaspiro[3.3]heptane
CID 121206984
(3R)-2,2-dimethyl-3-phenylpyrrolidine
CID 94411574

Frequently Asked Questions

What is the IUPAC name of (4R)-3,3-difluoro-4-phenylpiperidine?
The IUPAC name of (4R)-3,3-difluoro-4-phenylpiperidine (CID 97032408) is (4R)-3,3-difluoro-4-phenylpiperidine.
What is the SMILES notation for (4R)-3,3-difluoro-4-phenylpiperidine?
The canonical SMILES for (4R)-3,3-difluoro-4-phenylpiperidine is FC1(F)CNCC[C@@H]1c1ccccc1.
What is the InChIKey of (4R)-3,3-difluoro-4-phenylpiperidine?
The InChIKey is BAECOYBHZORNIT-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H13F2N/c12-11(13)8-14-7-6-10(11)9-4-2-1-3-5-9/h1-5,10,14H,6-8H2/t10-/m1/s1.
What are the key properties of (4R)-3,3-difluoro-4-phenylpiperidine?
(4R)-3,3-difluoro-4-phenylpiperidine has a molecular weight of 197.23 g/mol, XLogP of 2.40, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-3,3-difluoro-4-phenylpiperidine is sourced from PubChem (CID 97032408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).