2-[9-[4-(2-piperidin-1-ylethoxy)phenyl]fluoren-9-yl]phenol

C32H31NO2 — CID 174662801

IUPAC2-[9-[4-(2-piperidin-1-ylethoxy)phenyl]fluoren-9-yl]phenol
SMILESOc1ccccc1C1(c2ccc(OCCN3CCCCC3)cc2)c2ccccc2-c2ccccc21
InChIInChI=1S/C32H31NO2/c34-31-15-7-6-14-30(31)32(28-12-4-2-10-26(28)27-11-3-5-13-29(27)32)24-16-18-25(19-17-24)35-23-22-33-20-8-1-9-21-33/h2-7,10-19,34H,1,8-9,20-23H2
InChIKeyUMLAJBXMEHZFHS-UHFFFAOYSA-N
MW461.61 g/mol
LogP6.62
Rot. Bonds6

About 2-[9-[4-(2-piperidin-1-ylethoxy)phenyl]fluoren-9-yl]phenol

2-[9-[4-(2-piperidin-1-ylethoxy)phenyl]fluoren-9-yl]phenol (PubChem CID 174662801) has the molecular formula C32H31NO2 and a molecular weight of 461.61 g/mol. Its IUPAC name is 2-[9-[4-(2-piperidin-1-ylethoxy)phenyl]fluoren-9-yl]phenol.

Molecular Properties

Compound Name2-[9-[4-(2-piperidin-1-ylethoxy)phenyl]fluoren-9-yl]phenol
PubChem CID174662801
Molecular FormulaC32H31NO2
Molecular Weight461.61 g/mol
Exact Mass461.24
IUPAC Name2-[9-[4-(2-piperidin-1-ylethoxy)phenyl]fluoren-9-yl]phenol
SMILESOc1ccccc1C1(c2ccc(OCCN3CCCCC3)cc2)c2ccccc2-c2ccccc21
InChIInChI=1S/C32H31NO2/c34-31-15-7-6-14-30(31)32(28-12-4-2-10-26(28)27-11-3-5-13-29(27)32)24-16-18-25(19-17-24)35-23-22-33-20-8-1-9-21-33/h2-7,10-19,34H,1,8-9,20-23H2
InChIKeyUMLAJBXMEHZFHS-UHFFFAOYSA-N
XLogP6.62
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500461.61
LogP ≤ 56.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-1-[4-[9-[4-[(2S)-2-hydroxy-3-piperidin-1-ylpropoxy]phenyl]fluoren-9-yl]phenoxy]-3-piperidin-1-ylpropan-2-ol
CID 98308819
1-[2-(4-phenylphenoxy)ethyl]piperidine
CID 58483683
2-[4-[2-(azepan-1-yl)ethoxy]phenyl]isoindole-1,3-dione
CID 168516681
N-[4-[2-(azepan-1-yl)ethoxy]phenyl]-1-phenylcyclohexane-1-carboxamide
CID 100669515
1-[2-[4-[2-methylidene-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]cyclohexyl]phenoxy]ethyl]pyrrolidine
CID 172804677
1-[2-(4-methoxyphenoxy)ethyl]azepane
CID 888209
N-[4-[2-(azepan-1-yl)ethoxy]phenyl]-1-(2-chlorophenyl)cyclopentane-1-carboxamide
CID 100666686
2-(difluoromethyl)phenol;[4-(2-pyrrolidin-1-ylethoxy)phenyl]methanol
CID 145415542
1,4-bis(2-phenoxyethyl)-1,4-diazepane
CID 58861609
[4-[2-(azepan-1-yl)ethoxy]phenyl]methanol;hydrochloride
CID 78358370
2-[2-[2-[2-[2-[2-[4-[9-[4-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]phenyl]fluoren-9-yl]phenoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 155473515
N-[4-[2-(azepan-1-yl)ethoxy]phenyl]-1-(2-fluorophenyl)cyclohexane-1-carboxamide
CID 100673262

Frequently Asked Questions

What is the IUPAC name of 2-[9-[4-(2-piperidin-1-ylethoxy)phenyl]fluoren-9-yl]phenol?
The IUPAC name of 2-[9-[4-(2-piperidin-1-ylethoxy)phenyl]fluoren-9-yl]phenol (CID 174662801) is 2-[9-[4-(2-piperidin-1-ylethoxy)phenyl]fluoren-9-yl]phenol.
What is the SMILES notation for 2-[9-[4-(2-piperidin-1-ylethoxy)phenyl]fluoren-9-yl]phenol?
The canonical SMILES for 2-[9-[4-(2-piperidin-1-ylethoxy)phenyl]fluoren-9-yl]phenol is Oc1ccccc1C1(c2ccc(OCCN3CCCCC3)cc2)c2ccccc2-c2ccccc21.
What is the InChIKey of 2-[9-[4-(2-piperidin-1-ylethoxy)phenyl]fluoren-9-yl]phenol?
The InChIKey is UMLAJBXMEHZFHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H31NO2/c34-31-15-7-6-14-30(31)32(28-12-4-2-10-26(28)27-11-3-5-13-29(27)32)24-16-18-25(19-17-24)35-23-22-33-20-8-1-9-21-33/h2-7,10-19,34H,1,8-9,20-23H2.
What are the key properties of 2-[9-[4-(2-piperidin-1-ylethoxy)phenyl]fluoren-9-yl]phenol?
2-[9-[4-(2-piperidin-1-ylethoxy)phenyl]fluoren-9-yl]phenol has a molecular weight of 461.61 g/mol, XLogP of 6.62, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[9-[4-(2-piperidin-1-ylethoxy)phenyl]fluoren-9-yl]phenol is sourced from PubChem (CID 174662801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).