4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidine

C23H28FN — CID 158054931

IUPAC4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidine
SMILESFc1ccc(CC2(CC[C@@H]3CC3c3ccccc3)CCNCC2)cc1
InChIInChI=1S/C23H28FN/c24-21-8-6-18(7-9-21)17-23(12-14-25-15-13-23)11-10-20-16-22(20)19-4-2-1-3-5-19/h1-9,20,22,25H,10-17H2/t20-,22?/m1/s1
InChIKeyFJXSUUGAXDTRSB-PSDZMVHGSA-N
MW337.48 g/mol
LogP5.32
Rot. Bonds6

About 4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidine

4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidine (PubChem CID 158054931) has the molecular formula C23H28FN and a molecular weight of 337.48 g/mol. Its IUPAC name is 4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidine.

Molecular Properties

Compound Name4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidine
PubChem CID158054931
Molecular FormulaC23H28FN
Molecular Weight337.48 g/mol
Exact Mass337.22
IUPAC Name4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidine
SMILESFc1ccc(CC2(CC[C@@H]3CC3c3ccccc3)CCNCC2)cc1
InChIInChI=1S/C23H28FN/c24-21-8-6-18(7-9-21)17-23(12-14-25-15-13-23)11-10-20-16-22(20)19-4-2-1-3-5-19/h1-9,20,22,25H,10-17H2/t20-,22?/m1/s1
InChIKeyFJXSUUGAXDTRSB-PSDZMVHGSA-N
XLogP5.32
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.48
LogP ≤ 55.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidin-1-yl]pyridine-2-carboxylic acid
CID 148800033
N-[[4-[(4-fluorophenyl)methyl]piperidin-4-yl]methyl]-N-[(1R)-2-phenylcyclopropyl]acetamide
CID 118297691
4-[(4-fluorophenyl)methyl]-4-[(2-phenyl-1H-imidazol-5-yl)methyl]piperidine;dihydrochloride
CID 67691494
3-[[1-(cyclopropylmethyl)-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidin-4-yl]methyl]benzoic acid
CID 160736107
4-benzyl-4-fluoropiperidine;ethane
CID 154662481
trans-(1R,2S)-N-[(4-fluorophenyl)methyl]-2-phenylcyclopropan-1-amine
CID 46869734
2-(4-fluorophenyl)ethanamine;trans-(1S,2R)-2-phenylcyclopropan-1-amine;hydrochloride
CID 154961449
trans-(1R,2S)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-phenylcyclopropan-1-amine
CID 118290144
3-[4-[(5-fluoropyrimidin-2-yl)oxymethyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidin-1-yl]propanoic acid
CID 161315209
[2-(3-bromo-3-cyclopropylpropyl)cyclopropyl]benzene
CID 116518364
2-phenyl-N-[(3-propylpyrrolidin-3-yl)methyl]cyclopropan-1-amine
CID 63143291
1-[(1S,2S)-2-but-3-enylcyclopropyl]-4-fluorobenzene
CID 10058353

Frequently Asked Questions

What is the IUPAC name of 4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidine?
The IUPAC name of 4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidine (CID 158054931) is 4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidine.
What is the SMILES notation for 4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidine?
The canonical SMILES for 4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidine is Fc1ccc(CC2(CC[C@@H]3CC3c3ccccc3)CCNCC2)cc1.
What is the InChIKey of 4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidine?
The InChIKey is FJXSUUGAXDTRSB-PSDZMVHGSA-N. The full InChI is InChI=1S/C23H28FN/c24-21-8-6-18(7-9-21)17-23(12-14-25-15-13-23)11-10-20-16-22(20)19-4-2-1-3-5-19/h1-9,20,22,25H,10-17H2/t20-,22?/m1/s1.
What are the key properties of 4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidine?
4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidine has a molecular weight of 337.48 g/mol, XLogP of 5.32, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-fluorophenyl)methyl]-4-[2-[(1R)-2-phenylcyclopropyl]ethyl]piperidine is sourced from PubChem (CID 158054931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).