4-(4-bromophenyl)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-ol

C24H31BrN2O — CID 30983078

IUPAC4-(4-bromophenyl)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-ol
SMILESOC1(c2ccc(Br)cc2)CCN(C2CCN(CCc3ccccc3)CC2)CC1
InChIInChI=1S/C24H31BrN2O/c25-22-8-6-21(7-9-22)24(28)13-18-27(19-14-24)23-11-16-26(17-12-23)15-10-20-4-2-1-3-5-20/h1-9,23,28H,10-19H2
InChIKeyCOYYISTXBUNJNG-UHFFFAOYSA-N
MW443.43 g/mol
LogP4.44
Rot. Bonds5

About 4-(4-bromophenyl)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-ol

4-(4-bromophenyl)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-ol (PubChem CID 30983078) has the molecular formula C24H31BrN2O and a molecular weight of 443.43 g/mol. Its IUPAC name is 4-(4-bromophenyl)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-ol.

Molecular Properties

Compound Name4-(4-bromophenyl)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-ol
PubChem CID30983078
Molecular FormulaC24H31BrN2O
Molecular Weight443.43 g/mol
Exact Mass442.16
IUPAC Name4-(4-bromophenyl)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-ol
SMILESOC1(c2ccc(Br)cc2)CCN(C2CCN(CCc3ccccc3)CC2)CC1
InChIInChI=1S/C24H31BrN2O/c25-22-8-6-21(7-9-22)24(28)13-18-27(19-14-24)23-11-16-26(17-12-23)15-10-20-4-2-1-3-5-20/h1-9,23,28H,10-19H2
InChIKeyCOYYISTXBUNJNG-UHFFFAOYSA-N
XLogP4.44
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.43
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(4-bromophenyl)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-ol 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

1-Benzhydryl-4-(4-bromophenyl)piperidin-4-ol
CID 10093682
1-(4-Bromophenyl)-2-(4-phenyl-1-piperidyl)ethanol
CID 369973
4-(4-Bromophenyl)-1-[(3-bromophenyl)methyl]piperidin-4-ol
CID 1070039
1-(1-Benzylpiperidin-4-yl)-4-(4-bromophenyl)piperidin-4-ol
CID 30983285
1-((2-Bromophenyl)(phenyl)methyl)-4-phenylpiperidin-4-ol
CID 44426836
1-((4-Bromophenyl)(phenyl)methyl)-4-phenylpiperidin-4-ol
CID 44426837
1-(Bis(2-bromophenyl)methyl)-4-phenylpiperidin-4-ol
CID 44426842
4-(2-(Aminomethyl)phenyl)-1-((2-bromophenyl)(phenyl)methyl)piperidin-4-ol
CID 44430043
3-(4-Benzhydrylpiperazin-1-yl)-1-(4-bromophenyl)propan-1-ol
CID 145958139
5-[4-(4-Bromo-phenyl)-4-hydroxy-piperidin-1-yl]-2,2-diphenyl-pentanenitrile
CID 10576989
alpha-(p-Bromophenyl)-4-(alpha-hydroxy-alpha-phenylbenzyl)-1-piperidinebutanol
CID 19937427
(1-(4-Bromophenethyl)piperidin-4-yl)diphenylmethanol
CID 70672044

Frequently Asked Questions

What is the IUPAC name of 4-(4-bromophenyl)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-ol?
The IUPAC name of 4-(4-bromophenyl)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-ol (CID 30983078) is 4-(4-bromophenyl)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-ol.
What is the SMILES notation for 4-(4-bromophenyl)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-ol?
The canonical SMILES for 4-(4-bromophenyl)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-ol is OC1(c2ccc(Br)cc2)CCN(C2CCN(CCc3ccccc3)CC2)CC1.
What is the InChIKey of 4-(4-bromophenyl)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-ol?
The InChIKey is COYYISTXBUNJNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31BrN2O/c25-22-8-6-21(7-9-22)24(28)13-18-27(19-14-24)23-11-16-26(17-12-23)15-10-20-4-2-1-3-5-20/h1-9,23,28H,10-19H2.
What are the key properties of 4-(4-bromophenyl)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-ol?
4-(4-bromophenyl)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-ol has a molecular weight of 443.43 g/mol, XLogP of 4.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-bromophenyl)-1-[1-(2-phenylethyl)piperidin-4-yl]piperidin-4-ol is sourced from PubChem (CID 30983078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).